allpy
changeset 779:6d6285392ae4
Re-generated allpy.data.codes from newer components.cif
| author | Daniil Alexeyevsky <dendik@kodomo.fbb.msu.ru> |
|---|---|
| date | Tue, 12 Jul 2011 23:30:29 +0400 |
| parents | 9e0e0fb4908c |
| children | 231d59689d40 |
| files | allpy/data/codes.py |
| diffstat | 1 files changed, 123 insertions(+), 37 deletions(-) [+] |
line diff
1.1 --- a/allpy/data/codes.py Tue Jul 12 22:25:52 2011 +0400 1.2 +++ b/allpy/data/codes.py Tue Jul 12 23:30:29 2011 +0400 1.3 @@ -23,8 +23,6 @@ 1.4 ('a', True, "2AR", "2'-DEOXYARISTEROMYCIN-5'-PHOSPHATE"), 1.5 ('a', True, "2BU", "(2S,3S)-N6-(2,3,4-TRIHYDROXYBUTYL)-2'-DEOXYADENOSINE MONO PHOSPHORIC ACID"), 1.6 ('a', True, "2DA", "2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATE"), 1.7 -('a', True, "3DA", "3'-DEOXYADENOSINE-5'-MONOPHOSPHATE"), 1.8 -('a', True, "5AA", "N6-DIMETHYL-3'-AMINO-ADENOSINE-5'-MONOPHOSPHATE"), 1.9 ('a', True, "6HA", "1',5'-ANHYDRO-2',3'-DIDEOXY-2'-(ADENIN-9-YL)-6'-O-PHOSPHORYL-D-ARABINO-HEXITOL"), 1.10 ('a', True, "6MA", "N6-METHYL-DEOXY-ADENOSINE-5'-MONOPHOSPHATE"), 1.11 ('a', True, "7DA", "7-DEAZA-2'-DEOXYADENOSINE-5'-MONOPHOSPHATE"), 1.12 @@ -44,7 +42,6 @@ 1.13 ('a', True, "E", "N-((-)-(7S,8R,9S,10R)[7,8,9-TRIHYDROXY-7,8,9,10-TETRA HYDROBENZO[A]PYREN-10-YL])-2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE"), 1.14 ('a', True, "E1X", "PHOSPHORIC ACID MONO-[5-(1-ETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-PURIN-9-YL)-3-HYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL]ESTER"), 1.15 ('a', True, "EDA", "3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8-PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE"), 1.16 -('a', True, "FA2", "5-(6-AMINO-9H-PURIN-9-YL)-4-HYDROXYTETRAHYDROFURAN-3-YL DIHYDROGEN PHOSPHATE"), 1.17 ('a', True, "MA7", "1N-METHYLADENOSINE-5'-MONOPHOSPHATE"), 1.18 ('a', True, "PRN", "PURINE 2'-DEOXYRIBO-5'-MONOPHOSPHATE"), 1.19 ('a', True, "R", "2'-DEOXY-N6-(R)STYRENE OXIDE ADENOSINE MONOPHOSPHATE"), 1.20 @@ -79,8 +76,6 @@ 1.21 ('c', True, "C46", "6H,8H-3,4-DIHYDROPYRIMIDO[4,5-C][1,2]OXAZIN-7-0NE(CYTIDINE)-5'-MONOPHOSPHATE"), 1.22 ('c', True, "C49", "4-THIO,5-FLUORO,5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE"), 1.23 ('c', True, "C4S", "2'-DEOXY-4'-THIOCYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.24 -('c', True, "CAR", "CYTOSINE ARABINOSE-5'-PHOSPHATE"), 1.25 -('c', True, "CB2", "PHOSPHORIC ACID MONO-[5-(4-AMINO-5-BROMO-2-OXO-2H-PYRIMIDIN-1-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL] ESTER"), 1.26 ('c', True, "CBR", "5-BROMO-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE"), 1.27 ('c', True, "CDW", "(4R)-3-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-PENTOFURANOSYL)-1,3-DIAZABICYCLO[2.2.0]HEX-5-EN-2-ONE"), 1.28 ('c', True, "CFL", "4-AMINO-1-(2-DEOXY-2-FLUORO-5-O-PHOSPHONO-BETA-D-ARABINOFURANOSYL)PYRIMIDIN-2(1H)-ONE"), 1.29 @@ -107,7 +102,6 @@ 1.30 ('g', True, "0DG", "2'-DEOXY-L-RIBO-FURANOSYL GUANINE-5'-MONOPHOSPHATE"), 1.31 ('g', True, "2EG", "2'-DEOXY-N-ETHYLGUANOSINE 5'-PHOSPHATE"), 1.32 ('g', True, "2PR", "2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-9H-PURINE-5'-MONOPHOSPHATE"), 1.33 -('g', True, "5CG", "5'-CHLORO-5'-DEOXY-GUANOSINE"), 1.34 ('g', True, "6HG", "1',5'-ANHYDRO-2',3'-DIDEOXY-2'-(GUANIN-9-YL)-6'-O-PHOSPHORYL-D-ARABINO-HEXITOL"), 1.35 ('g', True, "6OG", "6-O-METHYL GUANOSINE-5'-MONOPHOSPHATE"), 1.36 ('g', True, "7GU", "7-DEAZA-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE"), 1.37 @@ -132,7 +126,6 @@ 1.38 ('g', True, "G42", "8-OXO-2'-DEOXY-GUANOSINE-5'-MONOPHOSPHATE"), 1.39 ('g', True, "G47", "N2-ETHANETHIOL-2'-DEOXY-GUANOSINE-5'-MONOPHOSPHATE"), 1.40 ('g', True, "G49", "N2-METHYL-2'-DEOXY-GUANOSINE-5'-MONOPHOSPHATE"), 1.41 -('g', True, "GDR", "GUANOSINE-5'-DIPHOSPHATE-RHAMNOSE"), 1.42 ('g', True, "GFL", "2-AMINO-9-(2-DEOXY-2-FLUORO-5-O-PHOSPHONO-BETA-D-ARABINOFURANOSYL)-1,9-DIHYDRO-6H-PURIN-6-ONE"), 1.43 ('g', True, "GMS", "2'-DEOXYGUANOSINE-5'-MONOSELENOPHOSPHATE"), 1.44 ('g', True, "GN7", "N7-2'-DEOXY-GUANOSINE-5'-MONOPHOSPHATE"), 1.45 @@ -140,7 +133,6 @@ 1.46 ('g', True, "GSR", "2'-DEOXY-N2-(R)STYRENE OXIDE GUANOSINE MONOPHOSPHATE"), 1.47 ('g', True, "GSS", "2'-DEOXY-N2-(S)STYRENE OXIDE GUANOSINE MONOPHOSPHATE"), 1.48 ('g', True, "IGU", "2'-DEOXYISOGUANINE-5'-MONOPHOSPHATE"), 1.49 -('g', True, "LCG", "[(1R,3R,4R,7S)-7-HYDROXY-3-(GUANIN-9-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.50 ('g', True, "LGP", "N9-1-HYDROXY-PROP-2-OXYMETHYL-GUANINE-3'-MONOPHOSPHATE"), 1.51 ('g', True, "M1G", "3-(2-DEOXY-BETA-D-RIBOFURANOSYL)-PYRIDO[5,6-A]-PURINE-10-ONE-5'-MONOPHOSPHATE"), 1.52 ('g', True, "MG1", "2'-DEOXY-1-METHYLGUANOSINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.53 @@ -167,6 +159,7 @@ 1.54 ('n', True, "2FI", "2'-FLUORO-2'-DEOXYINOSINE"), 1.55 ('n', True, "3DR", "1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATE"), 1.56 ('n', True, "47C", "2'-DEOXY-N-(PROP-2-EN-1-YLOXY)CYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.57 +('n', True, "4DG", "2-[(2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)METHOXY]ETHYL DIHYDROGEN PHOSPHATE"), 1.58 ('n', True, "4MF", "1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-PENTOFURANOSYL)-4-METHYL-1H-INDOLE"), 1.59 ('n', True, "5MD", "5-METHYL-2'-DEOXYPSEUDOURIDINE"), 1.60 ('n', True, "5UA", "5'-O-CARBOXY-2'-DEOXYADENOSINE"), 1.61 @@ -199,15 +192,14 @@ 1.62 ('n', True, "FAG", "[1',2'-DIDEOXY[2-AMINO-5-([9-HYDROXY-AFLATOXINB2-8-YL]-FORMYL-AMINO)-6-OXO-1,6-IHYDRO-PYRIMIDIN-4-YLAMINO]-RIBOFURANOSE]-5-MONOPHOSPHATE GROUP"), 1.63 ('n', True, "FDG", "2-AMINO-9-(2-DEOXY-2-FLUORO-5-O-PHOSPHONO-BETA-D-ARABINOFURANOSYL)-7,9-DIHYDRO-1H-PURINE-6,8-DIONE"), 1.64 ('n', True, "FFD", "(1R)-1,4-ANHYDRO-2-DEOXY-1-(3-FLUOROPHENYL)-5-O-PHOSPHONO-D-ERYTHRO-PENTITOL"), 1.65 +('n', True, "FNU", "6-AMINO-5-FLUOROURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.66 ('n', True, "G35", "(5R)-5-CARBAMIMIDAMIDO-1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-PENTOFURANOSYL)IMIDAZOLIDINE-2,4-DIONE"), 1.67 ('n', True, "GF2", "2'-DEOXY-2'-FLUOROGUANOSINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.68 ('n', True, "GNE", "1,N2-ETHENOGUANINE"), 1.69 ('n', True, "GX1", "2'-DEOXY-5'-O-{(S)-HYDROXY[(2-SULFANYLETHYL)AMINO]PHOSPHORYL}GUANOSINE"), 1.70 ('n', True, "HOL", "ALPHA-CHOLEST-5-EN-3-YL 3-[(2-DEOXY-5-O-PHOSPHONO-ALPHA-D-GLYCERO-PENTOFURANOSYL)OXY]PROPYLCARBAMATE"), 1.71 -('n', True, "IPN", "2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-5-IODOURACIL"), 1.72 -('n', True, "LCC", "[(1R,3R,4R,7S)-7-HYDROXY-3-(5-METHYLCYTOSIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.73 +('n', True, "JDT", "2'-DEOXY-5-ETHYLURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.74 ('n', True, "LCH", "[(1R,3R,4R,7S)-7-HYDROXY-3-(5-METHYLCYTOSIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.75 -('n', True, "LKC", "4-AMINO-1-[(1S,3R,4R,7S)-7-HYDROXY-1-(HYDROXYMETHYL)-2,5-DIOXABICYCLO[2.2.1]HEPT-3-YL]-5-METHYLPYRIMIDIN-2(1H)-ONE"), 1.76 ('n', True, "MBZ", "1-[2-DEOXYRIBOFURANOSYL]-4-METHYL-BENZOIMIDAZOLE-5'-MONOPHOSPHATE"), 1.77 ('n', True, "MDJ", "4-AMINO-1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-PENTOFURANOSYL)-3-(HYDROXYMETHYL)PYRIDIN-2(1H)-ONE"), 1.78 ('n', True, "MDK", "4-AMINO-1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-PENTOFURANOSYL)-3-METHYLPYRIDIN-2(1H)-ONE"), 1.79 @@ -223,11 +215,10 @@ 1.80 ('n', True, "NP3", "1-[2-DEOXY-RIBOFURANOSYL]-1H-[3-NITRO-PYRROL]-5'-PHOSPHATE"), 1.81 ('n', True, "NRI", "PHOSPHORIC ACID MONO-(4-HYDROXY-PYRROLIDIN-3-YLMETHYL) ESTER"), 1.82 ('n', True, "NYM", "3'-DEOXY-3'-AMINOTHYMIDINE MONOPHOSPHATE"), 1.83 -('n', True, "O2C", "3'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE"), 1.84 ('n', True, "OGX", "2'-DEOXY-5'-O-{(S)-HYDROXY[(2-SULFANYLETHYL)AMINO]PHOSPHORYL}-8-OXOGUANOSINE"), 1.85 ('n', True, "PBT", "[3-HYDROXY-5-(5-METHYL-2,4-DIOXOTETRAHYDRO-1(2H)-PYRIMIDINYL)TETRAHYDRO-2-FURANYL]METHYL DIHYDROGEN PHOSPHATE"), 1.86 ('n', True, "SOS", "[(1R,2S,4R)-4-({2-AMINO-5-[BENZYL(FORMYL)AMINO]-6-OXO-1,6-DIHYDROPYRIMIDIN-4-YL}AMINO)-2-HYDROXYCYCLOPENTYL]METHYL DIHYDROGEN PHOSPHATE"), 1.87 -('n', True, "T2T", "[(2S,3S,5R)-3-[(2S)-3-({[(2R,3S,4R,5R)-3-HYDROXY-4-METHOXY-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)TETRAHYDROFURAN-2-YL]METHYL}AMINO)-2-METHYL-3-OXOPROPYL]-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)TETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.88 +('n', True, "TED", "5-[(1E)-14-CARBOXY-10,13-BIS(CARBOXYMETHYL)-3,8-DIOXO-4,7,10,13-TETRAAZATETRADEC-1-EN-1-YL]-2'-DEOXYURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.89 ('n', True, "TFF", "5'-O-[(R)-{[(R)-[DIFLUORO(PHOSPHONO)METHYL](HYDROXY)PHOSPHORYL](DIFLUORO)METHYL}(HYDROXY)PHOSPHORYL]THYMIDINE"), 1.90 ('n', True, "THX", "PHOSPHONIC ACID 6-({6-[6-(6-CARBAMOYL-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBONYL)-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDOCENE-2-CARBONYL]-3,6,7,8-TETRAHYDRO-3,6-DIAZA-AS-INDACENE-2-CARBONL}-AMINO)-HEXYL ESTER 5-(5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-2-YLMETHYL ESTER"), 1.91 ('n', True, "TS", "THYMIDINE-5'-THIOPHOSPHATE"), 1.92 @@ -248,12 +239,7 @@ 1.93 ('n', True, "XTY", "(1R)-1,4-ANHYDRO-2-DEOXY-1-(6-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLIN-8-YL)-5-O-PHOSPHONO-D-ERYTHRO-PENTITOL"), 1.94 ('n', True, "YRR", "3-HYDROXY-PYRROLIDIN-2-YLMETHYL-MONOPHOSPHATE GROUP"), 1.95 ('t', True, "0DT", "2'-DEOXY-L-RIBO-FURANOSYL THYMIDINE-5'-MONOPHOSPHATE"), 1.96 -('t', True, "2AT", "2'-O-ALLYL THYMIDINE-5'-MONOPHOSPHATE"), 1.97 -('t', True, "2BT", "2'-O-BUTYL-THYMIDINE"), 1.98 ('t', True, "2DT", "3'-DEOXYTHYMIDINE-5'-MONOPHOSPHATE"), 1.99 -('t', True, "2GT", "2'-O-PROPARGYL THYMIDINE-5'-MONOPHOSPHATE"), 1.100 -('t', True, "2NT", "2'-O-[2-[HYDROXY(METHYLENEAMINO)OXY]ETHYL THYMIDINE-5'-MONOPHOSPHATE"), 1.101 -('t', True, "2OT", "2'-O-[2-(N,N-DIMETHYLAMINOOXY)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.102 ('t', True, "2ST", "5-METHYL-2'-SE-METHYL-2'-SELENOURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.103 ('t', True, "5AT", "5'-AMINO-5'-DEOXYTHYMIDINE"), 1.104 ('t', True, "5HT", "5-HYDROXY-THYMIDINE"), 1.105 @@ -263,22 +249,17 @@ 1.106 ('t', True, "6CT", "PHOSPHORIC ACID MONO-[5-HYDROXYMETHYL-2-METHYL-3-THYMINYL-CYCLOPENTYLMETHYL]ESTER GROUP"), 1.107 ('t', True, "6HT", "1',5'-ANHYDRO-2',3'-DIDEOXY-2'-(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-ARABINO-HEXITOL"), 1.108 ('t', True, "ATD", "THYMIDINE-3'-PHOSPHATE"), 1.109 -('t', True, "ATL", "[(1S,3R,4S,7R)-7-HYDROXY-3-(THYMIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.110 ('t', True, "ATM", "3'-AZIDO-3'-DEOXYTHYMIDINE-5'-MONOPHOSPHATE"), 1.111 -('t', True, "BOE", "2'-O-[2-(BENZYLOXY)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.112 ('t', True, "CTG", "(5R,6S)-5,6-DIHYDRO-5,6-DIHYDROXYTHYMIDINE-5'-MONOPHOSPHATE"), 1.113 ('t', True, "D3T", "2',3'-DIDEOXY-THYMIDINE-5'-TRIPHOSPHATE"), 1.114 ('t', True, "D4M", "[(5R)-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-2,5-DIHYDROFURAN-2-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.115 ('t', True, "DPB", "(S)-1-[2'-DEOXY-3',5'-O-(1-PHOSPHONO)BENZYLIDENE-B-D-THREO-PENTOFURANOSYL]THYMINE"), 1.116 ('t', True, "DRT", "2'-DEOXY-L-RIBO-FURANOSYL THYMINE-5'-MONOPHOSPHATE"), 1.117 -('t', True, "EIT", "((3R,4R,5R)-4-(2-(1H-IMIDAZOL-1-YL)ETHOXY)-3-HYDROXY-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-TETRAHYDROFURAN-2-YL)METHYL DIHYDROGEN PHOSPHATE"), 1.118 ('t', True, "MMT", "5'-O-(DIMETHYLAMINO)-THYMIDINE"), 1.119 ('t', True, "MTR", "(5-METHYL-6-OXO-1,6-DIHYDRO-PYRIDIN-3-YL)-1,2-DIDEOXY-RIBOFURANOSE-5-MONOPHOSPHATE"), 1.120 ('t', True, "NMS", "1-(O2-(2-METHYLAMINO-2-OXO-ETHYL)-O5-HYDROXYPHOSPHINYL-BETA-D-RIBOFURANOSYL)THYMINE"), 1.121 ('t', True, "NMT", "1-(O2-(METHYLCARBAMOYL)-O5-HYDROXYPHOSPHINYL-BETA-D-RIBOFURANOSYL)THYMINE"), 1.122 -('t', True, "P2T", "2'-O-PROPYL THYMIDINE-5-MONOPHOSPHATE"), 1.123 ('t', True, "PST", "THYMIDINE-5'-THIOPHOSPHATE"), 1.124 -('t', True, "S2M", "2'-O-[2-(METHOXY)ETHYL]-2-THIOTHYMIDINE-5'-MONOPHOSPHATE"), 1.125 ('t', True, "SPT", "5'-THIO-THYMIDINE PHOSPHONIC ACID"), 1.126 ('t', True, "T", "THYMIDINE-5'-MONOPHOSPHATE"), 1.127 ('t', True, "T32", "6'-ALPHA-METHYL CARBOCYCLIC THYMIDINE 5'-MONOPHOSPHATE"), 1.128 @@ -293,7 +274,6 @@ 1.129 ('t', True, "TAF", "2'-DEOXY-2'-FLUORO-ARABINO-FURANOSYL THYMINE-5'-PHOSPHATE"), 1.130 ('t', True, "TCP", "5'-METHYLTHYMIDINE"), 1.131 ('t', True, "TDY", "5-(METHYLAMINO)THYMIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.132 -('t', True, "TFE", "2'-O-[2-(TRIFLUORO)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.133 ('t', True, "TFT", "(L)-ALPHA-THREOFURANOSYL-THYMINE-3'-MONOPHOSPHATE"), 1.134 ('t', True, "TLC", "2-O,3-ETHDIYL-ARABINOFURANOSYL-THYMINE-5'-MONOPHOSPHATE"), 1.135 ('t', True, "TP1", "2-(METHYLAMINO)-ETHYLGLYCINE-CARBONYLMETHYLENE-THYMINE"), 1.136 @@ -304,7 +284,6 @@ 1.137 ('t', True, "XTL", "[(1S,4R,6R)-6-HYDROXY-4-(THYMIN-9-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.138 ('t', True, "XTR", "[(1R,4S,6S)-6-HYDROXY-4-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.139 ('u', True, "0AU", "5-IODOURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.140 -('u', True, "3ME", "PHOSPHORIC ACID MONO-[4-[2-(2-DIMETHYLAMINO-ETHOXY)-ETHOXY]-3-HYDROXY-5- (5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-2-YLMETHYL] ESTER"), 1.141 ('u', True, "5HU", "5-HYDROXYMETHYLURIDINE-2'-DEOXY-5'-MONOPHOSPHATE"), 1.142 ('u', True, "5IU", "5-IODO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE"), 1.143 ('u', True, "5SE", "2'-DEOXY-5-(METHYLSELANYL)CYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.144 @@ -313,14 +292,12 @@ 1.145 ('u', True, "DDN", "3,4-DIHYDRO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE"), 1.146 ('u', True, "DRM", "{[(1R,2S)-2-(2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)CYCLOPENTYL]OXY}METHYLPHOSPHONIC ACID"), 1.147 ('u', True, "DU", "2'-DEOXYURIDINE-5'-MONOPHOSPHATE"), 1.148 -('u', True, "GMU", "2'-O-[(2-GUANIDINIUM)ETHYL]-5-METHYLURIDINE 5'-MONOPHOSPHATE"), 1.149 ('u', True, "HDP", "[(1S,6S)-6-HYDROXY-4-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.150 ('u', True, "HEU", "3-(2-HYDROXYETHYL)-2'-DEOXYURIDINE-5'-MONOPHOSPHATE"), 1.151 ('u', True, "NDN", "2'-DEOXY-5-NITROURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.152 ('u', True, "P2U", "2'-DEOXY-PSEUDOURIDINE-5'MONOPHOSPHATE"), 1.153 ('u', True, "PDU", "5(1-PROPYNYL)-2'-DEOXYURIDINE-5-MONOPHOSPHATE"), 1.154 ('u', True, "T5O", "2'-DEOXY-5-METHOXYURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.155 -('u', True, "TLN", "[(1R,3R,4R,7S)-7-HYDROXY-3-(THYMIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.156 ('u', True, "TTI", "2'-DEOXY-5-TELLUROXOURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.157 ('u', True, "U2N", "2'-AMINO-2'-DEOXYURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.158 ('u', True, "U33", "5-BROMO-2'-DEOXY URIDINE"), 1.159 @@ -361,6 +338,7 @@ 1.160 ('a', True, "0CS", "3-[(S)-HYDROPEROXYSULFINYL]-L-ALANINE"), 1.161 ('a', True, "0NC", "N-METHYL-L-ALANINAMIDE"), 1.162 ('a', True, "1PI", "(3R)-3-[(2S)-2-AMINO-3-OXOPROPYL]PIPERIDINE-1-CARBOXIMIDAMIDE"), 1.163 +('a', True, "2AG", "(2S)-2-AMINOPENT-4-ENOIC ACID"), 1.164 ('a', True, "3GA", "(3S)-3-[(2S)-2-AMINO-3-OXOPROPYL]PIPERIDINE-1-CARBOXIMIDAMIDE"), 1.165 ('a', True, "AA3", "2-AMINOBUTYRIC ACID"), 1.166 ('a', True, "AA4", "2-AMINO-5-HYDROXYPENTANOIC ACID"), 1.167 @@ -377,7 +355,6 @@ 1.168 ('a', True, "AYA", "N-ACETYLALANINE"), 1.169 ('a', True, "B2A", "ALANINE BORONIC ACID"), 1.170 ('a', True, "B3A", "(3S)-3-AMINOBUTANOIC ACID"), 1.171 -('a', True, "BNN", "ACETYL-P-AMIDINOPHENYLALANINE"), 1.172 ('a', True, "DAB", "2,4-DIAMINOBUTYRIC ACID"), 1.173 ('a', True, "DAL", "D-ALANINE"), 1.174 ('a', True, "DBZ", "3-(BENZOYLAMINO)-L-ALANINE"), 1.175 @@ -385,7 +362,6 @@ 1.176 ('a', True, "DPP", "DIAMMINOPROPANOIC ACID"), 1.177 ('a', True, "FLA", "TRIFLUOROALANINE"), 1.178 ('a', True, "HAC", "BETA-CYCLOHEXYL-ALANINE"), 1.179 -('a', True, "HMF", "2-AMINO-4-PHENYL-BUTYRIC ACID"), 1.180 ('a', True, "HQA", "3-(8-HYDROXYQUINOLIN-3-YL)-L-ALANINE"), 1.181 ('a', True, "HV5", "TERT-BUTYLALANINE"), 1.182 ('a', True, "IAM", "4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE"), 1.183 @@ -412,6 +388,7 @@ 1.184 ('c', True, "0A8", "S-[(2-CHLOROETHYL)CARBAMOYL]-L-CYSTEINE"), 1.185 ('c', True, "143", "S-2,3-DIHYDRO-5-GLYCIN-2-YL-ISOXAZOL-3-YL-CYSTEINE"), 1.186 ('c', True, "2CO", "S-HYDROPEROXYCYSTEINE"), 1.187 +('c', True, "2XA", "(2R)-2-AMINO-3-[(4-CHLOROPHENYL)-DIPHENYL-METHYL]SULFANYL-PROPANOIC ACID"), 1.188 ('c', True, "5CS", "2-AMINO-3-(CYSTEIN-S-YL)-ISOXAZOLIDIN-5-YL-ACETIC ACID"), 1.189 ('c', True, "BB6", "(2Z)-2-AMINO-3-SULFANYLBUT-2-ENOIC ACID"), 1.190 ('c', True, "BB7", "(2Z)-2-AMINO-4-METHOXY-3-SULFANYLBUT-2-ENOIC ACID"), 1.191 @@ -510,7 +487,7 @@ 1.192 ('d', True, "0A0", "2-METHYL-L-ASPARTIC ACID"), 1.193 ('d', True, "0AK", "(2S)-2-AMINO-4-(2-CHLOROETHOXY)-4-OXOBUTANOIC ACID"), 1.194 ('d', True, "3MD", "2S,3S-3-METHYLASPARTIC ACID"), 1.195 -('d', True, "ACB", "3-METHYL-ASPARTIC ACID"), 1.196 +('d', True, "ACB", "3-METHYL-BETA-D-ASPARTIC ACID"), 1.197 ('d', True, "AEI", "THREONINE-ASPARTIC ESTER"), 1.198 ('d', True, "AKL", "3-AMINO-5-CHLORO-4-OXOPENTANOIC ACID"), 1.199 ('d', True, "AS2", "(2R)-2-AMINO-4-OXOBUTANOIC ACID"), 1.200 @@ -527,7 +504,7 @@ 1.201 ('d', True, "DMK", "3,3-DIMETHYL ASPARTIC ACID"), 1.202 ('d', True, "DOH", "BETA-HYDROXY ASPARTIC ACID"), 1.203 ('d', True, "DSP", "D-ASPARTIC ACID"), 1.204 -('d', True, "IAS", "L-ASPARTIC ACID"), 1.205 +('d', True, "IAS", "BETA-L-ASPARTIC ACID"), 1.206 ('d', True, "LAA", "(3R)-3-HYDROXY-L-ALPHA-ASPARAGINE"), 1.207 ('d', True, "OHS", "O-(CARBOXYSULFANYL)-4-OXO-L-HOMOSERINE"), 1.208 ('d', True, "OXX", "OXALYL-ASPARTYL ANHYDRIDE"), 1.209 @@ -540,11 +517,10 @@ 1.210 ('e', True, "B3E", "(3S)-3-AMINOHEXANEDIOIC ACID"), 1.211 ('e', True, "CGA", "CARBOXYMETHYLATED GLUTAMIC ACID"), 1.212 ('e', True, "CGU", "GAMMA-CARBOXY-GLUTAMIC ACID"), 1.213 -('e', True, "CRU", "4-[(4Z)-1-(CARBOXYMETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-2-YL]-4-IMINOBUTANOIC ACID"), 1.214 ('e', True, "DGL", "D-GLUTAMIC ACID"), 1.215 -('e', True, "FGA", "D-GLUTAMIC ACID"), 1.216 +('e', True, "FGA", "GAMMA-D-GLUTAMIC ACID"), 1.217 ('e', True, "GAU", "(4S)-4-AMINO-5-HYDROXYPENTANOIC ACID"), 1.218 -('e', True, "GGL", "L-GLUTAMIC ACID"), 1.219 +('e', True, "GGL", "GAMMA-L-GLUTAMIC ACID"), 1.220 ('e', True, "GLQ", "4-AMINO-5-OXO-PENTANOIC ACID"), 1.221 ('e', True, "GMA", "4-AMIDO-4-CARBAMOYL-BUTYRIC ACID"), 1.222 ('e', True, "GSU", "O5'-(L-GLUTAMYL-SULFAMOYL)-ADENOSINE"), 1.223 @@ -565,6 +541,7 @@ 1.224 ('f', True, "B1F", "PHENYLALANINE BORONIC ACID"), 1.225 ('f', True, "B2F", "PHENYLALANINE BORONIC ACID"), 1.226 ('f', True, "BIF", "(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID"), 1.227 +('f', True, "BNN", "ACETYL-P-AMIDINOPHENYLALANINE"), 1.228 ('f', True, "DAH", "3,4-DIHYDROXYPHENYLALANINE"), 1.229 ('f', True, "EHP", "3-HYDROXYPHENYLALANINE"), 1.230 ('f', True, "F2F", "3,4-DIFLUORO-L-PHENYLALANINE"), 1.231 @@ -592,11 +569,9 @@ 1.232 ('f', True, "T11", "4-[3-(TRIFLUOROMETHYL)DIAZIRIDIN-3-YL]-L-PHENYLALANINE"), 1.233 ('f', True, "TFQ", "4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE"), 1.234 ('g', True, "0AC", "(4S,5S)-5-AMINO-4-HYDROXY-6-PHENYLHEXANOIC ACID"), 1.235 -('g', True, "2AG", "(2S)-2-AMINOPENT-4-ENOIC ACID"), 1.236 ('g', True, "3XH", "3-HYDROXYHIPPURIC ACID"), 1.237 ('g', True, "CHP", "3-CHLORO-4-HYDROXYPHENYLGLYCINE"), 1.238 ('g', True, "CR5", "(2R)-2-(AMINOMETHYL)-2,4-DIHYDROXY-5-OXO-3-(2-OXOETHYL)-2,5-DIHYDRO-1H-IMIDAZOL-3-IUM"), 1.239 -('g', True, "CSI", "AMINO-(2-IMINO-HEXAHYDRO-PYRIMIDIN-4-YL)-ACETIC ACID"), 1.240 ('g', True, "D3P", "(2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID"), 1.241 ('g', True, "DGH", "(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID"), 1.242 ('g', True, "FGL", "2-AMINOPROPANEDIOIC ACID"), 1.243 @@ -647,6 +622,7 @@ 1.244 ('i', True, "ILX", "4,5-DIHYDROXYISOLEUCINE"), 1.245 ('i', True, "IML", "N-METHYL-ISOLEUCINE"), 1.246 ('k', True, "0A2", "[(1R)-1,5-DIAMINOPENTYL][BIS(ETHANOLATO)]HYDROXYBORATE(1-)"), 1.247 +('k', True, "3QN", "(E)-N~6~-{2-HYDROXY-3-METHYL-6-[(PHOSPHONOOXY)METHYL]BENZYLIDENE}-L-LYSINE"), 1.248 ('k', True, "6CL", "6-CARBOXYLYSINE"), 1.249 ('k', True, "6HN", "6-NITRO-L-NORLEUCINE"), 1.250 ('k', True, "ALY", "N(6)-ACETYLLYSINE"), 1.251 @@ -683,6 +659,7 @@ 1.252 ('k', True, "LLP", "2-LYSINE(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHANE)"), 1.253 ('k', True, "LLY", "NZ-(DICARBOXYMETHYL)LYSINE"), 1.254 ('k', True, "LP6", "6-PIPERIDIN-1-YL-L-NORLEUCINE"), 1.255 +('k', True, "LYK", "(2S)-2,6-DIAMINOHEXANE-1,1-DIOL"), 1.256 ('k', True, "LYM", "DEOXY-METHYL-LYSINE"), 1.257 ('k', True, "LYN", "2,6-DIAMINO-HEXANOIC ACID AMIDE"), 1.258 ('k', True, "LYR", "N~6~-[(2Z,4E,6E,8E)-3,7-DIMETHYL-9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)NONA-2,4,6,8-TETRAENYL]LYSINE"), 1.259 @@ -747,6 +724,7 @@ 1.260 ('m', True, "MT2", "[(3S)-3-AMINO-3-CARBOXYPROPYL](ETHYL)METHYLSULFONIUM"), 1.261 ('m', True, "OMT", "S-DIOXYMETHIONINE"), 1.262 ('m', True, "SME", "METHIONINE SULFOXIDE"), 1.263 +('n', True, "A5N", "O-CARBOXY-4-IMINO-L-HOMOSERINE"), 1.264 ('n', True, "AFA", "N-[7-METHYL-OCT-2,4-DIENOYL]ASPARAGINE"), 1.265 ('n', True, "AHB", "BETA-HYDROXYASPARAGINE"), 1.266 ('n', True, "B3X", "(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACID"), 1.267 @@ -802,6 +780,7 @@ 1.268 ('r', True, "IAR", "(2E)-5-[(DIAMINOMETHYLIDENE)AMINO]-2-IMINOPENTANOIC ACID"), 1.269 ('r', True, "MAI", "DEOXO-METHYLARGININE"), 1.270 ('r', True, "MGG", "2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID"), 1.271 +('r', True, "MMO", "N~2~-METHYL-L-ARGININE"), 1.272 ('r', True, "NMM", "(2S)-2-AMINO-5-[(N-METHYLCARBAMIMIDOYL)AMINO]PENTANOIC ACID"), 1.273 ('r', True, "NNH", "NOR-N-OMEGA-HYDROXY-L-ARGININE"), 1.274 ('r', True, "OPR", "(5S)-5-AMINO-8-CARBAMIMIDAMIDO-4-OXOOCTANOIC ACID"), 1.275 @@ -843,6 +822,8 @@ 1.276 ('s', True, "SOY", "OXACILLIN-ACYLATED SERINE"), 1.277 ('s', True, "SUN", "O-[(R)-(DIMETHYLAMINO)(ETHOXY)PHOSPHORYL]-L-SERINE"), 1.278 ('s', True, "SVA", "SERINE VANADATE"), 1.279 +('s', True, "SVV", "O-[(S)-AMINO(HYDROXY)PHOSPHORYL]-L-SERINE"), 1.280 +('s', True, "SVW", "O-[(R)-AMINO(HYDROXY)PHOSPHORYL]-L-SERINE"), 1.281 ('s', True, "SVX", "O-[(R)-ETHOXY(METHYL)PHOSPHORYL]-L-SERINE"), 1.282 ('s', True, "TNR", "O-(2-ACETAMIDO-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL)-L-SERINE"), 1.283 ('t', True, "26B", "O-TERT-BUTYL-N-[(3-{[(2,4,6-TRIMETHYLPHENYL)CARBAMOYL]AMINO}NAPHTHALEN-2-YL)CARBONYL]-L-THREONINE"), 1.284 @@ -873,6 +854,7 @@ 1.285 ('v', True, "DHV", "3-HYDROXY-D-VALINE"), 1.286 ('v', True, "DIV", "D-ISOVALINE"), 1.287 ('v', True, "DVA", "D-VALINE"), 1.288 +('v', True, "FVA", "N-FORMYL-L-VALINE"), 1.289 ('v', True, "HVA", "3-HYDROXY-L-VALINE"), 1.290 ('v', True, "LEI", "3-SULFANYL-D-VALINE"), 1.291 ('v', True, "LVN", "(3S)-4-OXO-L-VALINE"), 1.292 @@ -887,6 +869,7 @@ 1.293 ('w', True, "4DP", "3-[5-(DIMETHYLAMINO)-1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL]-L-ALANINE"), 1.294 ('w', True, "4FW", "4-FLUOROTRYPTOPHANE"), 1.295 ('w', True, "4HT", "4-HYDROXYTRYPTOPHAN"), 1.296 +('w', True, "4IN", "4-AMINO-L-TRYPTOPHAN"), 1.297 ('w', True, "6CW", "6-CHLORO-L-TRYPTOPHAN"), 1.298 ('w', True, "BTR", "6-BROMO-TRYPTOPHAN"), 1.299 ('w', True, "CTE", "7-CHLOROTRYPTOPHAN"), 1.300 @@ -902,6 +885,7 @@ 1.301 ('w', True, "TCR", "CYCLOMETHYLTRYPTOPHAN"), 1.302 ('w', True, "TOX", "2-AMINO-3-(1-HYDROPEROXY-1H-INDOL-3-YL)PROPAN-1-OL"), 1.303 ('w', True, "TPL", "TRYPTOPHANOL"), 1.304 +('w', True, "TQI", "N-{[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]SULFONYL}-L-TRYPTOPHAN"), 1.305 ('w', True, "TQQ", "(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO-7-OXO-1H-INDOL-3-YL)PROPANOIC ACID"), 1.306 ('w', True, "TRF", "N1-FORMYL-TRYPTOPHAN"), 1.307 ('w', True, "TRN", "NZ2-TRYPTOPHAN"), 1.308 @@ -918,6 +902,7 @@ 1.309 ('x', True, "011", "7-AMINOHEPTANOIC ACID"), 1.310 ('x', True, "01W", "(2S)-2-AMMONIO-4-[(2,4-DINITROPHENYL)AMINO]BUTANOATE"), 1.311 ('x', True, "038", "3-[[(2S)-2-[[[(2S)-2-[[(2S)-2-[[(2S)-2-AZANYL-3-(1H-1,2,3,4-TETRAZOL-5-YLCARBONYLAMINO)PROPANOYL]AMINO]-3-METHYL-BUTANOYL]AMINO]-4-METHYL-PENTANOYL]AMINO]METHYL]-2-HYDROXY-4-PHENYL-BUTANOYL]AMINO]BENZOIC ACID"), 1.312 +('x', True, "074", "[PROPYLAMINO-3-HYDROXY-BUTAN-1,4-DIONYL]-ISOLEUCYL-PROLINE"), 1.313 ('x', True, "075", "(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-3-(METHYLSULFONYL)-L-ALANYL}AMINO)-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.314 ('x', True, "0A9", "METHYL L-PHENYLALANINATE"), 1.315 ('x', True, "0AY", "DIETHYL [(1R)-1,5-DIAMINOPENTYL]BORONATE"), 1.316 @@ -928,13 +913,21 @@ 1.317 ('x', True, "0EZ", "TERT-BUTYL [(1S,2S)-1-BENZYL-2-HYDROXY-3-{[(8S,11R)-8-[(1R)-1-METHYLPROPYL]-7,10-DIOXO-2-OXA-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-TRIEN-11-YL]AMINO}PROPYL]CARBAMATE"), 1.318 ('x', True, "0FA", "N~2~-PHOSPHONO-L-LEUCINAMIDE"), 1.319 ('x', True, "0G6", "D-PHENYLALANYL-N-[(2S,3S)-6-{[AMINO(IMINIO)METHYL]AMINO}-1-CHLORO-2-HYDROXYHEXAN-3-YL]-L-PROLINAMIDE"), 1.320 +('x', True, "0G7", "D-PHENYLALANYL-N-[(3S)-6-CARBAMIMIDAMIDO-1-CHLORO-2-OXOHEXAN-3-YL]-L-PROLINAMIDE"), 1.321 ('x', True, "0HG", "N-[(4S)-4-AMMONIO-4-CARBOXYBUTANOYL]-S-(4-BROMOBENZYL)-L-CYSTEINYLGLYCINE"), 1.322 ('x', True, "0PJ", "N-[(S)-({[(BENZYLOXY)CARBONYL]AMINO}METHYL)(HYDROXY)PHOSPHORYL]-L-LEUCYL-L-LEUCINE"), 1.323 ('x', True, "0PN", "N-[(BENZYLOXY)CARBONYL]-L-VALYL-L-ALANYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-SERINE"), 1.324 ('x', True, "0PQ", "N-{(2R)-3-[(S)-[(1R)-1-AMINO-2-PHENYLETHYL](HYDROXY)PHOSPHORYL]-2-BENZYLPROPANOYL}-L-PHENYLALANINE"), 1.325 ('x', True, "0Z6", "D-PHENYLALANYL-N-[(2S,3S)-6-{[AMINO(IMINIO)METHYL]AMINO}-1-CHLORO-2-HYDROXYHEXAN-3-YL]-L-PHENYLALANINAMIDE"), 1.326 +('x', True, "10U", "(S)-N-(4-CARBAMIMIDOYLBENZYL)-1-(2-(CYCLOPENTYLAMINO)ETHANOYL)PYRROLIDINE-2-CARBOXAMIDE"), 1.327 ('x', True, "11U", "(S)-N-(4-CARBAMIMIDOYLBENZYL)-1-(2-(CYCLOHEXYLAMINO)ETHANOYL)PYRROLIDINE-2-CARBOXAMIDE"), 1.328 +('x', True, "162", "(2-{2-[(5-CARBAMIMIDOYL-1-METHYL-1H-PYRROL-3-YLMETHYL)-CARBAMOYL]-PYRROL-1-YL} -1-CYCLOHEXYLMETHYL-2-OXO-ETHYLAMINO)-ACETIC ACID"), 1.329 +('x', True, "163", "(2-{2-[(5-CARBAMIMIDOYL-1-METHYL-1H-PYRROL-2-YLMETHYL)-CARBAMOYL]-PYRROL-1-YL}- 1-CYCLOHEXYLMETHYL-2-OXO-ETHYLAMINO)-ACETIC ACID"), 1.330 +('x', True, "165", "N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL-N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE"), 1.331 ('x', True, "16U", "N-(3-CHLOROBENZYL)-1-(4-METHYLPENTANOYL)-L-PROLINAMIDE"), 1.332 +('x', True, "176", "1-(2-AMINO-3,3-DIPHENYL-PROPIONYL)-PYRROLIDINE-3-CARBOXYLIC ACID 2,5-DICHLORO-BENZYLAMIDE"), 1.333 +('x', True, "177", "1-[2-AMINO-2-CYCLOHEXYL-ACETYL]-PYRROLIDINE-3-CARBOXYLIC ACID 5-CHLORO-2-(2-ETHYLCARBAMOYL-ETHOXY)-BENZYLAMIDE"), 1.334 +('x', True, "192", "1-AMINOCYCLOBUTANECARBOXLIC ACID"), 1.335 ('x', True, "193", "(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACID"), 1.336 ('x', True, "19U", "1-[(2R)-2-AMINOBUTANOYL]-N-(3-CHLOROBENZYL)-L-PROLINAMIDE"), 1.337 ('x', True, "1ZD", "N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE"), 1.338 @@ -947,7 +940,9 @@ 1.339 ('x', True, "2AS", "(2S,3S)-3-METHYL-ASPARTIC ACID"), 1.340 ('x', True, "2DO", "(2S)-2-AMINOHEXANE-1,1-DIOL"), 1.341 ('x', True, "2NC", "N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE"), 1.342 +('x', True, "2P0", "1-({[(S)-HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}ACETYL)-L-PROLINE"), 1.343 ('x', True, "2PI", "2-AMINO-PENTANOIC ACID"), 1.344 +('x', True, "2RA", "3-AMINO-D-ALANINE"), 1.345 ('x', True, "2SI", "2-O-SULFO-A-L-IDURONIC ACID"), 1.346 ('x', True, "2TS", "(2S)-N-[[2-(AMINOMETHYL)-5-CHLORO-PHENYL]METHYL]-1-[(2R)-5-CARBAMIMIDAMIDO-2-(PHENYLMETHYLSULFONYLAMINO)PENTANOYL]PYRROLIDINE-2-CARBOXAMIDE"), 1.347 ('x', True, "2Z9", "N-ACETYL-L-ALPHA-ASPARTYL-L-ALPHA-GLUTAMYL-N-[(2S)-1-CARBOXY-3-HYDROXYPROPAN-2-YL]-L-VALINAMIDE"), 1.348 @@ -955,6 +950,7 @@ 1.349 ('x', True, "32T", "(S)-2-AMINO-3-(4H-THIENO[3,2-B]-PYRROL-6-YL)-PROPIONIC ACID"), 1.350 ('x', True, "32U", "D-PHENYLALANYL-N-{4-[AMINO(IMINIO)METHYL]BENZYL}-L-PROLINAMIDE"), 1.351 ('x', True, "33U", "BETA-PHENYL-D-PHENYLALANYL-N-(4-CARBAMIMIDOYLBENZYL)-L-PROLINAMIDE"), 1.352 +('x', True, "34P", "N-(CARBOXYMETHYL)-3-CYCLOHEXYL-D-ALANYL-N-({4-[(E)-AMINO(IMINO)METHYL]-1,3-THIAZOL-2-YL}METHYL)-L-PROLINAMIDE"), 1.353 ('x', True, "37U", "D-PHENYLALANYL-N-(3-FLUOROBENZYL)-L-PROLINAMIDE"), 1.354 ('x', True, "3A1", "N~2~-{(2S)-3-[(R)-HYDROXY{(1R)-2-PHENYL-1-[(PHENYLACETYL)AMINO]ETHYL}PHOSPHORYL]-2-METHYLPROPANOYL}-L-LYSYL-D-SERINE"), 1.355 ('x', True, "3A2", "1-{3-[(R)-{(1R)-1-[(GLYCYL-L-PROLYL)AMINO]-2-PHENYLETHYL}(HYDROXY)PHOSPHORYL]PROPANOYL}-L-PROLYL-D-NORLEUCINE"), 1.356 @@ -964,16 +960,21 @@ 1.357 ('x', True, "3GL", "(2S,4S)-2-AMINO-4-HYDROXY-PENTANEDIOIC ACID"), 1.358 ('x', True, "3MM", "(1R)-1-CARBOXY-N,N,N-TRIMETHYL-3-(METHYLSULFANYL)PROPAN-1-AMINIUM"), 1.359 ('x', True, "3MY", "3-CHLORO-D-TYROSINE"), 1.360 +('x', True, "3O3", "N-[(3S)-3-AMINO-3-CARBOXYPROPYL]-L-GLUTAMIC ACID"), 1.361 +('x', True, "3QP", "(E)-N-{2-HYDROXY-3-METHYL-6-[(PHOSPHONOOXY)METHYL]BENZYLIDENE}-L-ASPARTIC ACID"), 1.362 +('x', True, "3SP", "N-(CARBOXYMETHYL)-3-CYCLOHEXYL-D-ALANYL-N-({5-[(E)-AMINO(IMINO)METHYL]THIEN-2-YL}METHYL)-L-PROLINAMIDE"), 1.363 ('x', True, "3TL", "BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE"), 1.364 ('x', True, "3TY", "3-[(3E)-3-(BENZYLHYDRAZONO)-4-HYDROXY-6-OXOCYCLOHEXA-1,4-DIEN-1-YL]-L-ALANINE"), 1.365 ('x', True, "40A", "N-[(2S)-2-AMINOPROPYL]-N-[(6-AMINO-9H-PURIN-9-YL)ACETYL]GLYCINE"), 1.366 ('x', True, "40C", "N-[(4-AMINO-2-OXOPYRIMIDIN-1(2H)-YL)ACETYL]-N-[(2S)-2-AMINOPROPYL]GLYCINE"), 1.367 ('x', True, "40G", "N-[(2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)ACETYL]-N-[(2S)-2-AMINOPROPYL]GLYCINE"), 1.368 ('x', True, "40T", "N-[(2S)-2-AMINOPROPYL]-N-[(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)ACETYL]GLYCINE"), 1.369 +('x', True, "45U", "(S)-N-(4-CARBAMIMIDOYLBENZYL)-1-(2-(CYCLOPENTYLOXY)ETHANOYL)PYRROLIDINE-2-CARBOXAMIDE"), 1.370 +('x', True, "46U", "(S)-N-(4-CARBAMIMIDOYLBENZYL)-1-(2-(CYCLOHEXYLOXY)ETHANOYL)PYRROLIDINE-2-CARBOXAMIDE"), 1.371 ('x', True, "4AF", "4-ACETYL-L-PHENYLALANINE"), 1.372 ('x', True, "4DB", "(2S)-2-AMINO-4-[5-(DIMETHYLAMINO)-1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL]BUTANOIC ACID"), 1.373 -('x', True, "4IN", "4-AMINO-L-TRYPTOPHAN"), 1.374 ('x', True, "4MM", "(1S)-1-CARBOXY-N,N,N-TRIMETHYL-3-(METHYLSULFANYL)PROPAN-1-AMINIUM"), 1.375 +('x', True, "50U", "(S)-N-(4-CARBAMIMIDOYLBENZYL)-1-(3-CYCLOHEXYLPROPANOYL)PYRROLIDINE-2-CARBOXAMIDE"), 1.376 ('x', True, "51U", "D-PHENYLALANYL-N-(3-METHYLBENZYL)-L-PROLINAMIDE"), 1.377 ('x', True, "53U", "D-PHENYLALANYL-N-BENZYL-L-PROLINAMIDE"), 1.378 ('x', True, "5FE", "5,5,5-TRIFLUORO-3-HYDROXY-4-[2-(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-METHYL-2-[3-METHYL-2-(3-METHYL-BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-PENTANOYLAMINO)-PROPIONYLAMINO]-PENTANOIC ACID METHYL ESTER"), 1.379 @@ -984,6 +985,7 @@ 1.380 ('x', True, "7HA", "N-(3-{[2-(4-CHLOROPHENYL)-5-METHYL-1,3-OXAZOL-4-YL]METHOXY}BENZYL)-N-(METHOXYCARBONYL)GLYCINE"), 1.381 ('x', True, "7MN", "(Z)-N-[(1E)-1-CARBOXY-2-(2,3-DIHYDRO-1H-INDOL-1-YL)ETHYLIDENE]{3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4(1H)-YLIDENE}METHANAMINIUM"), 1.382 ('x', True, "91U", "N-ACETYL-3-CYCLOHEXYL-D-ALANYL-N-(3-CHLOROBENZYL)-L-PROLINAMIDE"), 1.383 +('x', True, "95A", "TMC-95A"), 1.384 ('x', True, "9DN", "DANSYL-L-ASPARAGINE"), 1.385 ('x', True, "9DS", "DANSYL-L-SARCOSINE"), 1.386 ('x', True, "9PR", "N-METHYL-L-PROLINAMIDE"), 1.387 @@ -992,9 +994,11 @@ 1.388 ('x', True, "A66", "2-AMINOETHYLLYSINE-CARBONYLMETHYLENE-ADENINE"), 1.389 ('x', True, "A67", "N~2~-{8-OXO-8-[4-(9H-PURIN-6-YL)PIPERAZIN-1-YL]OCTANOYL}-D-ARGINYL-D-ARGINYL-D-ARGINYL-D-ARGINYL-D-ARGINYL-D-ARGININAMIDE"), 1.390 ('x', True, "A70", "N-ETHYL-N-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-D-PHENYLALANYL-N-[(1S,2S,4R)-4-(BUTYLCARBAMOYL)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-5-METHYLHEXYL]-L-NORLEUCINAMIDE"), 1.391 +('x', True, "A9A", "1-(SULFOGLYCOLOYL-LEUCYL-THREONYL-VALYL-N-METHYLTYROSYL-LEUCYL)-3-(ARGINYLANYLAMINO)-6-HYDROXY-2-PIPERIDONE"), 1.392 ('x', True, "A9D", "(2S)-2-AMINO-2-CARBOXYETHYL 1-CARBOXY-L-PROLYL-L-PROLINATE"), 1.393 ('x', True, "AA6", "3-[4,5-DIHYDROXY-2-2-(2-HYDROXYETHYLAMINO)-PHENYL]-2-METHYLAMINO-PROPIONIC ACID"), 1.394 ('x', True, "AB7", "ALPHA-AMINOBUTYRIC ACID"), 1.395 +('x', True, "AC5", "1-AMINOCYCLOPENTANECARBOXYLIC ACID"), 1.396 ('x', True, "ADD", "2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-9-METHOXYNONANOIC ACID"), 1.397 ('x', True, "AEA", "(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-ACETIC ACID"), 1.398 ('x', True, "AEB", "AERUGINOSIN 98-B"), 1.399 @@ -1005,7 +1009,9 @@ 1.400 ('x', True, "AHH", "AMINO-HYDROXYHEPTANOIC ACID"), 1.401 ('x', True, "AHS", "(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-BUTYL)-ISOBUTYL-CARBAMIC ACID"), 1.402 ('x', True, "AHT", "4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-PHENOL"), 1.403 +('x', True, "AIP", "ANTIPAIN"), 1.404 ('x', True, "ALG", "4-CARBAMIMIDAMIDOBUTANOIC ACID"), 1.405 +('x', True, "ALZ", "2-[N'-(4-AMINO-BUTYL)-HYDRAZINOCARBONYL]-PYRROLIDINE-1-CARBOXYLIC ACID BENZYL ESTER"), 1.406 ('x', True, "AN6", "5'-{[(3S)-3-AMINO-3-CARBOXYPROPYL](ETHYL)AMINO}-5'-DEOXYADENOSINE"), 1.407 ('x', True, "APE", "(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACID"), 1.408 ('x', True, "APM", "M-AMIDINOPHENYL-3-ALANINE"), 1.409 @@ -1017,10 +1023,12 @@ 1.410 ('x', True, "ARX", "(2S,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-N-(6-{[(1R)-4-CARBAMIMIDAMIDO-1-{[(1R)-4-CARBAMIMIDAMIDO-1-CARBAMOYLBUTYL]CARBAMOYL}BUTYL]AMINO}-6-OXOHEXYL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-CARBOXAMIDE"), 1.411 ('x', True, "AS9", "N-[HYDROXY(METHYL)PHOSPHORYL]-L-ASPARTIC ACID"), 1.412 ('x', True, "ASM", "2-AMINO-4-OXO-4(1H-PYRROL-1-YL)BUTANOIC ACID"), 1.413 +('x', True, "ATN", "N-[(2S,3R)-3-AMINO-2-HYDROXY-4-PHENYL-BUTANOYL]-L-PROLYL-L-PROLYL-L-ALANINAMIDE"), 1.414 ('x', True, "AVN", "(2S)-AMINO[(5S)-3-CHLORO-4,5-DIHYDROISOXAZOL-5-YL]ACETIC ACID"), 1.415 ('x', True, "AYI", "(1R,2S,3R,1S',1S'')PHOSPHORIC ACID MONO(4-{2-[1-(1,2-DICARBAMOYLETHYLCARBAMOYL)-3-CARBAMOYLPROPYLCARBAMOYL]-3-METHYLCARBAMOYLCYCLOPROPYL}PHENYL) ESTER"), 1.416 ('x', True, "AYQ", "N~2~-({(1R,2R,3S)-2-(METHYLCARBAMOYL)-3-[4-(PHOSPHONOOXY)PHENYL]CYCLOPROPYL}CARBONYL)-D-GLUTAMINYL-D-ASPARTAMIDE"), 1.417 ('x', True, "AZ0", "ETHYL (5S,8S,14S)-14-HYDROXY-5,8,11-TRIS(2-METHYLPROPYL)-3,6,9,12-TETRAOXO-1-PHENYL-2-OXA-4,7,10,11-TETRAAZAPENTADECAN-15-OATE"), 1.418 +('x', True, "AZL", "1-ETHOXYCARBONYL-D-PHE-PRO-2(4-AMINOBUTYL)HYDRAZINE"), 1.419 ('x', True, "B27", "(2R,3S) 3-AMINO-4-MERCAPTO-2-BUTANOL"), 1.420 ('x', True, "B3L", "(3S)-3-AMINO-5-METHYLHEXANOIC ACID"), 1.421 ('x', True, "B3M", "(3R)-3-AMINO-5-(METHYLSULFANYL)PENTANOIC ACID"), 1.422 @@ -1031,13 +1039,17 @@ 1.423 ('x', True, "BE2", "2-AMINOBENZOIC ACID"), 1.424 ('x', True, "BIL", "(3R,4S)-3-AMINO-4-METHYLHEXANOIC ACID"), 1.425 ('x', True, "BJH", "1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-HYDROXYPHENYL)ETHYL BORONIC ACID"), 1.426 +('x', True, "BM2", "S-(R*,R*)]-4-[AMINOIMINOMETHYL)AMINO]-N-[[1-[3-HYDROXY -2-[(2-NAPHTHALENYLSULFONYL)AMINO]-1-OXOPROPYL]-2-PYRROLIDINYL] METHYL]BUTANAMIDE"), 1.427 +('x', True, "BM9", "[S-(R*,R*)]-1-(AMINOIMINOMETHYL)-N-[[1-[N-[(2-NAPHTHALENYLSULFONYL)-L-SERYL]-3-PYRROLIDINYL]METHYL]-3-PIPERIDENECARBOXAMIDE"), 1.428 ('x', True, "BNO", "NORLEUCINE BORONIC ACID"), 1.429 ('x', True, "BTK", "N~6~-BUTANOYL-L-LYSINE"), 1.430 ('x', True, "C1T", "S-[(1S,6R)-3,6-DIHYDROXY-4-METHYL-2,5-DIOXOCYCLOHEX-3-EN-1-YL]-L-CYSTEINE"), 1.431 +('x', True, "C2N", "3-CHLORO-D-ALANINE"), 1.432 ('x', True, "C66", "2-AMINOETHYLLYSINE-CARBONYLMETHYLENE-CYTOSINE"), 1.433 ('x', True, "CAB", "4,4-DIHYDROXY-5-OXO-L-NORVALINE"), 1.434 ('x', True, "CAL", "5-AMINO-6-CYCLOHEXYL-4-HYDROXY-2-ISOBUTYL-HEXANOIC ACID"), 1.435 ('x', True, "CAV", "5-AMINO-6-CYCLOHEXYL-3,4-DIHYDROXY-2-ISOPROPYL-HEXANOIC ACID"), 1.436 +('x', True, "CCR", "[N-[N-(4-METHOXY-2,3,6-TRIMETHYLPHENYLSULFONYL)-L-ASPARTYL]-D-(4-AMIDINO-PHENYLALANYL)]-PIPERIDINE"), 1.437 ('x', True, "CDE", "1,2-DIMETHYL-PROPYLAMINE"), 1.438 ('x', True, "CDV", "3-METHYL-2-UREIDO-BUTYRIC ACID"), 1.439 ('x', True, "CHF", "CYCLOHEXYLFLUOROSTATONE"), 1.440 @@ -1050,6 +1062,7 @@ 1.441 ('x', True, "CPN", "2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-CYTOSINE"), 1.442 ('x', True, "CUC", "CYCLOHEXYLGLYCYL "), 1.443 ('x', True, "CUD", "3-(4-AMINO-2-OXOPYRIMIDIN-1(2H)-YL)-D-ALANINE"), 1.444 +('x', True, "CWD", "3-(5-CHLORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-L-ALANINE"), 1.445 ('x', True, "CYJ", "(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)-4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]-L-LYSINE"), 1.446 ('x', True, "D4P", "(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID"), 1.447 ('x', True, "DA2", "NG,NG-DIMETHYL-L-ARGININE"), 1.448 @@ -1071,8 +1084,10 @@ 1.449 ('x', True, "E17", "N-{(1S,2S)-1-BENZYL-3-[(4R)-5,5-DIMETHYL-4-{[(1R)-1,2,2-TRIMETHYLPROPYL]CARBAMOYL}-1,3-THIAZOLIDIN-3-YL]-2-HYDROXY-3-OXOPROPYL}-3-METHYL-N~2~-{(2S)-2-[(MORPHOLIN-4-YLACETYL)AMINO]-2-PHENYLACETYL}-L-VALINAMIDE"), 1.450 ('x', True, "E19", "N-{(3R,4S)-4-[(L-ALANYL-L-PROLYL-L-GLUTAMINYL-L-VALYL)AMINO]-3-HYDROXY-6-METHYLHEPTANOYL}-L-VALYL-L-METHIONYL-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANYL-L-PROLINE"), 1.451 ('x', True, "ECX", "S-ETHYL-L-CYSTEINE"), 1.452 +('x', True, "ELY", "N~6~,N~6~-DIETHYL-L-LYSINE"), 1.453 ('x', True, "EOV", "(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ETHYL-33-[(1R,2R,4E)-1-HYDROXY-2-METHYLHEX-4-EN-1-YL]-1,4,7,10,12,15,19,25,28-NONAMETHYL-3,21-BIS(1-METHYLETHYL)-6,9,18,24-TETRAKIS(2-METHYLPROPYL)-1,4,7,10,13,16,19,22,25,28,31-UNDECAAZACYCLOTRITRIACONTANE-2,5,8,11,14,17,20,23,26,29,32-UNDECONE"), 1.454 ('x', True, "EP2", "METHYL N-[(2S)-4-{[(1S)-1-{[(2S)-2-CARBOXYPYRROLIDIN-1-YL]CARBONYL}-3-METHYLBUTYL]AMINO}-2-HYDROXY-4-OXOBUTANOYL]-L-LEUCYLGLYCYLGLYCINATE"), 1.455 +('x', True, "EP9", "N-[(BENZYLOXY)CARBONYL]-L-LEUCYL-N-[(2S,3S)-3-HYDROXY-1-(4-HYDROXYPHENYL)-4-OXOBUTAN-2-YL]-L-LEUCINAMIDE"), 1.456 ('x', True, "ETA", "ETHANOLAMINE"), 1.457 ('x', True, "EYG", "{(2R,4Z)-2-[(1R)-1-AMINO-3-(METHYLSULFANYL)PROPYL]-2-HYDROXY-4-[(4-HYDROXYPHENYL)METHYLIDENE]-5-OXOIMIDAZOLIDIN-1-YL}ACETIC ACID"), 1.458 ('x', True, "EYS", "S-SELANYLCYSTEINAL"), 1.459 @@ -1089,6 +1104,7 @@ 1.460 ('x', True, "FYI", "N-{(2S)-4-(METHYLAMINO)-4-OXO-2-[4-(PHOSPHONOOXY)BENZYL]BUTANOYL}-L-ISOLEUCYL-L-ASPARTAMIDE"), 1.461 ('x', True, "FYQ", "N~2~-{(2R)-4-(METHYLAMINO)-4-OXO-2-[4-(PHOSPHONOOXY)BENZYL]BUTANOYL}-L-GLUTAMINYL-L-ASPARTAMIDE"), 1.462 ('x', True, "G01", "N-[(R)-HYDROXY(METHYL)PHOSPHORYL]-D-GLUTAMIC ACID"), 1.463 +('x', True, "GAH", "N-{[(2S)-1-(N-{[4-({[AMINO(IMINO)METHYL]AMINO}METHYL)CYCLOHEXYL]CARBONYL}-3-CYCLOHEXYL-L-ALANYL)AZETIDIN-2-YL]CARBONYL}-L-TYROSYL-N~6~-[AMINO(IMINO)METHYL]-L-LYSINAMIDE"), 1.464 ('x', True, "GCM", "GLYCYLMETHYLENE GROUP"), 1.465 ('x', True, "GHC", "N-({4-[(2-AMINO-6-ETHYL-4-OXO-3,4-DIHYDROTHIENO[2,3-D]PYRIMIDIN-5-YL)SULFANYL]PHENYL}CARBONYL)-L-GLUTAMIC ACID"), 1.466 ('x', True, "GHW", "N-({4-[(2-AMINO-6-METHYL-4-OXO-3,4-DIHYDROTHIENO[2,3-D]PYRIMIDIN-5-YL)SULFANYL]PHENYL}CARBONYL)-L-GLUTAMIC ACID"), 1.467 @@ -1105,6 +1121,7 @@ 1.468 ('x', True, "HF2", "(2R)-2-HYDROXY-3-PHENYLPROPANOIC ACID"), 1.469 ('x', True, "HFA", "ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID"), 1.470 ('x', True, "HGL", "(2S)-2-AMINO-4-(2-AMINO-6-OXO-1,6-DIHYDRO-9H-PURIN-9-YL)BUTANOIC ACID"), 1.471 +('x', True, "HMF", "2-AMINO-4-PHENYL-BUTYRIC ACID"), 1.472 ('x', True, "HNC", "S-[(1S,2R)-2-HYDROXY-1-(2-OXOETHYL)HEPTYL]-L-CYSTEINE"), 1.473 ('x', True, "HOX", "4-AMINO-L-PHENYLALANINE"), 1.474 ('x', True, "HP0", "(3S,4AS,8AS)-2-[(2R,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]DECAHYDROISOQUINOLINE-3-CARBOXYLIC ACID"), 1.475 @@ -1112,6 +1129,7 @@ 1.476 ('x', True, "I0X", "NALPHA-[(BENZYLOXY)CARBONYL]-N-[(1S)-1-(4-TERT-BUTOXYBENZYL)-3-DIAZO-2-OXOPROPYL]-L-PHENYLALANINAMIDE"), 1.477 ('x', True, "I0Y", "NALPHA-[(BENZYLOXY)CARBONYL]-N-[(2S)-1-(4-TERT-BUTOXYPHENYL)-4-HYDROXY-3-OXOBUTAN-2-YL]-L-PHENYLALANINAMIDE"), 1.478 ('x', True, "IHN", "N-(3-METHYLBUTANOYL)-L-VALYL-N-[(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)-2-CARBOXY-1-HYDROXYETHYL]-3-METHYLBUTYL}AMINO)-1-METHYL-2-OXOETHYL]AMINO}-2-HYDROXY-1-(2-METHYLPROPYL)-4-OXOBUTYL]-L-VALINAMIDE"), 1.479 +('x', True, "INN", "N-{(2R)-2-[2-(HYDROXYAMINO)-2-OXOETHYL]-4-METHYLPENTANOYL}-3-METHYL-L-VALYL-N-(2-AMINOETHYL)-L-ALANINAMIDE"), 1.480 ('x', True, "JE2", "(4R)-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-N-(2-METHYLBENZYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.481 ('x', True, "JZP", "(4R)-3-[(2S,3S)-3-{[(2,6-DICHLOROPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.482 ('x', True, "JZQ", "(4R)-3-[(2S,3S)-3-{[(2,6-DIFLUOROPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.483 @@ -1119,14 +1137,18 @@ 1.484 ('x', True, "KBE", "BETA-LYSINE"), 1.485 ('x', True, "KNI", "(4R)-N-TERT-BUTYL-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL-L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.486 ('x', True, "KNJ", "(4R)-3-[(2S,3S)-3-{[(4-AMINO-2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-5,5-DIMETHYL-N-(2-METHYLPROP-2-EN-1-YL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.487 +('x', True, "KPN", "N-(2-AMINOETHYL)-N-(2,2'-BIPYRIDIN-5-YLACETYL)GLYCINE"), 1.488 ('x', True, "KYN", "(2S)-2-AMINO-4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID"), 1.489 ('x', True, "L2A", "(2S,5S,8S,11S,15E,20S)-20-AMINO-2-(CARBOXYMETHYL)-11,20-DIMETHYL-5,8-BIS(2-METHYLPROPYL)-3,6,9,21-TETRAOXO-1,4,7,10-TETRAAZACYCLOHENICOS-15-ENE-11-CARBOXYLIC ACID"), 1.490 ('x', True, "L3A", "(2R)-3-[(R)-[(1R)-1-AMINO-3-METHYLBUTYL](HYDROXY)PHOSPHORYL]-2-METHYLPROPANOIC ACID"), 1.491 ('x', True, "L3O", "(2S,3S)-3-AMINO-2-HYDROXY-5-METHYLHEXANOIC ACID"), 1.492 +('x', True, "LDE", "(2R)-2-{[(S)-[(1R)-1-AMINO-3-METHYLBUTYL](HYDROXY)PHOSPHORYL]METHYL}PENTANEDIOIC ACID"), 1.493 ('x', True, "LE1", "3-SULFANYL-L-VALINE"), 1.494 ('x', True, "LEP", "N~2~-PHOSPHONO-L-LEUCINAMIDE"), 1.495 ('x', True, "LET", "(Z)-N^6-{3-CARBOXY-1-[(4-CARBOXY-2-OXOBUTOXY)METHYL]PROPYLIDENE}-L-LYSINE"), 1.496 ('x', True, "LHC", "(2S)-2-AMINO-4-(4-AMINO-2-OXOPYRIMIDIN-1(2H)-YL)BUTANOIC ACID"), 1.497 +('x', True, "LLO", "N~6~-[(1S)-3-HYDROXY-1,3-DIMETHYLBUTYL]-L-LYSINE"), 1.498 +('x', True, "LLZ", "N~6~-[(1S)-3-(6-METHOXYNAPHTHALEN-2-YL)-1-METHYL-3-OXOPROPYL]-L-LYSINE"), 1.499 ('x', True, "LNT", "N-[(2S)-2-AMINO-1,1-DIHYDROXY-4-METHYLPENTYL]-L-THREONINE"), 1.500 ('x', True, "LOL", "LEUCINOL"), 1.501 ('x', True, "LOV", "5-AMINO-4-HYDROXY-2-ISOPROPYL-7-METHYL-OCTANOIC ACID"), 1.502 @@ -1134,9 +1156,11 @@ 1.503 ('x', True, "LSO", "(Z)-N~6~-(3-CARBOXY-1-{[(4-CARBOXY-2-OXOBUTYL)SULFONYL]METHYL}PROPYLIDENE)-L-LYSINE"), 1.504 ('x', True, "LTA", "4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTER"), 1.505 ('x', True, "LWY", "1-[(R)-HYDROXY(METHYL)PHOSPHORYL]-L-PROLINE"), 1.506 +('x', True, "LYU", "N~6~-(4-METHYLPENTYL)-L-LYSINE"), 1.507 ('x', True, "M3R", "METHYL PHOSPHONATED L-ARGININE"), 1.508 ('x', True, "MCG", "(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE"), 1.509 ('x', True, "MDH", "N-METHYLDEHYDROBUTYRINE"), 1.510 +('x', True, "MDL", "[DEHYDROXY-N-METHYL-TYROSYL-PROLINYL]-[4,4,5,5,5-PENTAFLUORO-3-OXY-1-[3-INDOLYL]-PENT-2-YL]AMINE"), 1.511 ('x', True, "ME0", "HYDROXY-L-METHIONINE"), 1.512 ('x', True, "MF3", "2-AMINO-4-TRIFLUOROMETHYLSULFANYL-BUTYRIC ACID"), 1.513 ('x', True, "MH1", "1-METHYL-L-HISTIDINE"), 1.514 @@ -1146,9 +1170,12 @@ 1.515 ('x', True, "MHV", "4-OXO-L-PIPECOLIC ACID"), 1.516 ('x', True, "MHW", "3-HYDROXYPICOLINIC ACID"), 1.517 ('x', True, "MID", "1-[N-(NAPHTHALEN-2-YLSULFONYL)GLYCYL-4-CARBAMIMIDOYL-D-PHENYLALANYL]PIPERIDINE"), 1.518 +('x', True, "MIN", "METHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINE"), 1.519 ('x', True, "MIR", "MONOETHYLPHOSPHORYLSERINE"), 1.520 ('x', True, "MIT", "AMINO{[(4S)-5-[(2R,4R)-2-CARBOXY-4-METHYLPIPERIDIN-1-YL]-4-({[(3R)-3-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-8-YL]SULFONYL}AMINO)-5-OXOPENTYL]AMINO}METHANIMINIUM"), 1.521 +('x', True, "MIU", "N-{(1S)-1-{[4-(3-AMINOPROPYL)PIPERAZIN-1-YL]CARBONYL}-4-[(DIAMINOMETHYLENE)AMINO]BUTYL}-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE"), 1.522 ('x', True, "MOD", "L-METHIONYL ADENYLATE"), 1.523 +('x', True, "MOQ", "MOTUPORIN"), 1.524 ('x', True, "MPH", "(1-AMINO-3-METHYLSULFANYL-PROPYL)-PHOSPHONIC ACID"), 1.525 ('x', True, "MPJ", "(1-AMINO-3-METHYLSULFANYL-PROPYL)-PHOSPHINIC ACID"), 1.526 ('x', True, "MSP", "5'-O-[(L-METHIONYL)-SULPHAMOYL]ADENOSINE"), 1.527 @@ -1161,6 +1188,7 @@ 1.528 ('x', True, "NOT", "6-AZIDO-L-NORLEUCINE"), 1.529 ('x', True, "NRG", "N-OMEGA-NITRO-L-ARGININE"), 1.530 ('x', True, "NSK", "N-SUCCINYL LYSINE"), 1.531 +('x', True, "NWD", "3-(5-NITRO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-L-ALANINE"), 1.532 ('x', True, "NYB", "N-METHYL-S-[(1R)-1-METHYLPROPYL]-L-CYSTEINE"), 1.533 ('x', True, "O12", "N~5~-DODECANOYL-L-ORNITHINE"), 1.534 ('x', True, "O33", "(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL-L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE"), 1.535 @@ -1168,6 +1196,7 @@ 1.536 ('x', True, "OBS", "(Z)-N^6-[(4S,5R)-5-(2-CARBOXYETHYL)-4-(CARBOXYMETHYL)-1-HYDROXYDIHYDRO-2H-THIOPYRANIUM-3(4H)-YLIDENE]-L-LYSINE"), 1.537 ('x', True, "ODA", "9-AMINO-6,10-DIOXO-OCTAHYDRO-PYRIDAZINO[1,2-A][1,2]DIAZEPINE-1-CARBOXYLIC ACID"), 1.538 ('x', True, "ODS", "4-METHYLPIPERAZINE-1-CARBOXYLIC ACID"), 1.539 +('x', True, "OEM", "N-METHYL-D-ASPARTIC ACID"), 1.540 ('x', True, "OIC", "OCTAHYDROINDOLE-2-CARBOXYLIC ACID"), 1.541 ('x', True, "OLE", "2-HYDROXY-4-METHYL-PENTANOIC ACID"), 1.542 ('x', True, "OMH", "O-[(S)-HYDROXY(METHOXY)PHOSPHORYL]-L-SERINE"), 1.543 @@ -1179,33 +1208,43 @@ 1.544 ('x', True, "OZT", "(4S,5R)-5-METHYL-2-OXO-1,3-OXAZOLIDINE-4-CARBOXYLIC ACID"), 1.545 ('x', True, "P2Q", "2-HYDROXY-5-{[(1S,2E)-1-FORMYL-4-PHENOXYBUT-2-EN-1YL]AMINO}-L-TYROSINE"), 1.546 ('x', True, "P3Q", "2-HYDROXY-5-{[(1E)-1-(2-OXOETHYLIDENE)-4-PHENYLBUTYL]AMINO}-L-TYROSINE"), 1.547 +('x', True, "P4D", "(2R)-2-{[(S)-[(1R)-1-AMINO-2-(4-HYDROXYPHENYL)ETHYL](HYDROXY)PHOSPHORYL]METHYL}BUTANEDIOIC ACID"), 1.548 +('x', True, "P5D", "(2R)-2-{[(S)-[(1R)-1-AMINO-2-PHENYLETHYL](HYDROXY)PHOSPHORYL]METHYL}BUTANEDIOIC ACID"), 1.549 ('x', True, "PCE", "2-(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-BUTYL)-PENT-4-YNOIC ACID"), 1.550 ('x', True, "PDD", "N-(5'-PHOSPHOPYRIDOXYL)-D-ALANINE"), 1.551 ('x', True, "PDL", "N-(5'-PHOSPHOPYRIDOXYL)-L-ALANINE"), 1.552 ('x', True, "PFX", "(2S)-1-({2-[2-(CARBOXYMETHOXY)ETHOXY]ETHYL}AMINO)-1-OXO-3-(4-PHOSPHONOPHENYL)PROPAN-2-AMINIUM"), 1.553 ('x', True, "PGL", "(AMINOMETHYL)PHOSPHONIC ACID"), 1.554 +('x', True, "PHW", "N-[(BENZYLOXY)CARBONYL]-BETA-PHENYL-D-PHENYLALANYL-N-{(1S,3E)-1-[DIHYDROXY(DIPHENOXY)-LAMBDA~5~-PHOSPHANYL]-4-METHOXYBUT-3-EN-1-YL}-L-PROLINAMIDE"), 1.555 ('x', True, "PIV", "PIVALIC ACID"), 1.556 ('x', True, "PKR", "(2S)-1-METHYLPYRROLIDINE-2-CARBALDEHYDE"), 1.557 ('x', True, "PNZ", "P-NITRO-BENZYLAMINE"), 1.558 ('x', True, "PPH", "[(1R)-1-AMINO-2-PHENYLETHYL]PHOSPHONIC ACID"), 1.559 +('x', True, "PPX", "[PHENYLALANINYL-PROLINYL]-[2-(PYRIDIN-4-YLAMINO)-ETHYL]-AMINE"), 1.560 ('x', True, "PR0", "3(S)-AMINO-4-PHENYL-BUTAN-2(R)-OL"), 1.561 ('x', True, "PR4", "1-[(2R)-2-CARBOXY-2-HYDROXYETHYL]-L-PROLINE"), 1.562 +('x', True, "PR7", "1-[(2S)-2-CARBOXY-2-HYDROXYETHYL]-L-PROLINE"), 1.563 ('x', True, "PRK", "N~6~-PROPANOYL-L-LYSINE"), 1.564 ('x', True, "PRQ", "(3S)-3-AMINO-3-(2-NITROPHENYL)PROPANOIC ACID"), 1.565 ('x', True, "PRR", "3-(METHYL-PYRIDINIUM)ALANINE"), 1.566 ('x', True, "PRV", "(2R)-AMINO(2-NITROPHENYL)ETHANOIC ACID"), 1.567 ('x', True, "PS0", "3(S)-AMINO-4-PHENYL-BUTAN-2(S)-OL"), 1.568 ('x', True, "PSI", "METHYL N-{(4S,5S)-5-[(L-ALANYL-L-ALANYL)AMINO]-4-HYDROXY-6-PHENYLHEXANOYL}-L-VALYL-L-VALINATE"), 1.569 +('x', True, "PSM", "N-[DIHYDROXY(PROPYL)-LAMBDA~4~-SULFANYL]THREONYL-N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}METHIONINAMIDE"), 1.570 ('x', True, "PSS", "(2S)-2-[(3R)-3-BENZYL-2-OXOPIPERAZIN-1-YL]HEXANOIC ACID"), 1.571 ('x', True, "PTA", "[(1-AMINO-3-METHYL-BUTYL)-HYDROXY-PHOSPHINOYL]-ACETIC ACID"), 1.572 ('x', True, "PVL", "PYRUVOYL GROUP"), 1.573 ('x', True, "QDS", "N-(QUINOXALIN-2-YLCARBONYL)-D-SERINE"), 1.574 ('x', True, "R2P", "(2R)-2-AMINO-3-(4-HYDROXY-1,2,5-THIADIAZOL-3-YL)PROPANOIC ACID"), 1.575 +('x', True, "R99", "N-[3-CARBOXY-2-HYDROXY-PROPIONYL]-D-HOMOPHENYLALANYL-AMINO-2-METHYLBUTANE"), 1.576 +('x', True, "RA4", "N-(4-NITROBENZOYL)-L-LEUCYL-N-(4-{[AMINO(IMINO)METHYL]AMINO}BUTYL)-L-PROLINAMIDE"), 1.577 +('x', True, "RA8", "N-(BENZYLSULFONYL)-L-LEUCYL-N-(4-{[AMINO(IMINO)METHYL]AMINO}BUTYL)-L-PROLINAMIDE"), 1.578 ('x', True, "RDF", "N-ALPHA-L-RHAMNOPYRANOSYLOXY(HYDROXYPHOSPHINYL)-L-LEUCYL-L-TRYPTOPHAN"), 1.579 ('x', True, "RGI", "METHYLCARBAMIC ACID"), 1.580 ('x', True, "RGL", "ARGINAL"), 1.581 ('x', True, "RIG", "ARGADIN"), 1.582 ('x', True, "RIT", "RITONAVIR"), 1.583 +('x', True, "RL2", "N-[3-CARBOXY-2-HYDROXY-PROPIONYL]-L-HOMOPHENYLALANYL-AMINO-2-METHYLBUTANE"), 1.584 ('x', True, "ROC", "(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE"), 1.585 ('x', True, "RON", "NORVALINE"), 1.586 ('x', True, "RX4", "N~2~-ACETYL-N-{(1R)-1-[(S)-[(2S)-3-{[(2S)-1-AMINO-1-OXOPROPAN-2-YL]AMINO}-2-METHYL-3-OXOPROPYL](HYDROXY)PHOSPHORYL]-2-PHENYLETHYL}-L-ALPHA-ASPARAGINE"), 1.587 @@ -1217,11 +1256,15 @@ 1.588 ('x', True, "SUB", "3-PHENYL-2-{[4-(TOLUENE-4-SULFONYL)-THIOMORPHOLINE-3-CARBONYL]-AMINO}-PROPIONIC ACID ETHYL ESTER"), 1.589 ('x', True, "SVZ", "O-[(S)-HYDROXY(ISOPROPYLAMINO)PHOSPHORYL]-D-SERINE"), 1.590 ('x', True, "SXE", "O-{(S)-ETHOXY[(1-METHYLETHYL)AMINO]PHOSPHORYL}-L-SERINE"), 1.591 +('x', True, "T0I", "(2S)-2-AMINO-3-(2,4-DIHYDROXY-5-IMIDAZOL-1-YL-PHENYL)PROPANOIC ACID"), 1.592 +('x', True, "T19", "PHENYLMETHYLENECARBOXY-(METHYLENEAMINO-FORMYL-DIPHENYLMETHYL)METHY-PRO-BOROVAL"), 1.593 +('x', True, "T42", "MORPHOLINO-DIPHENYLALANINE-METHOXYPROPYLBORONIC ACID"), 1.594 ('x', True, "T66", "2-AMINOETHYLLYSINE-CARBONYLMETHYLENE-THYMINE"), 1.595 ('x', True, "TA4", "(S)-2-[4-(AMINOMETHYL)-1H-1,2,3-TRIAZOL-1-YL]-4-METHYLPENTANOIC ACID"), 1.596 ('x', True, "TCK", "N-[(1S)-5-AMINO-1-(CHLOROACETYL)PENTYL]-4-METHYLBENZENESULFONAMIDE"), 1.597 ('x', True, "TCQ", "3-((3E)-4-(HYDROXYMETHYL)-6-OXO-3-{[(1S,2R)-2-PHENYLCYCLOPROPYL]IMINO}CYCLOHEXA-1,4-DIEN-1-YL)ALANINE"), 1.598 ('x', True, "TEF", "4-(2H-TETRAZOL-2-YL)-L-PHENYLALANINE"), 1.599 +('x', True, "TH5", "O-ACETYL-L-THREONINE"), 1.600 ('x', True, "THO", "REDUCED THREONINE"), 1.601 ('x', True, "TIG", "N-(2-AMINOETHYL)-L-TRYPTOPHAN"), 1.602 ('x', True, "TIS", "O-(1,1-DIHYDROXYETHYL)-L-SERINE"), 1.603 @@ -1243,12 +1286,15 @@ 1.604 ('x', True, "UN1", "2-AMINOHEXANEDIOIC ACID"), 1.605 ('x', True, "UN2", "2-AMINO-4,4-DIHYDROXYBUTANOIC ACID"), 1.606 ('x', True, "UNK", "UNKNOWN"), 1.607 +('x', True, "VAH", "(3R)-3-HYDROXY-L-NORVALINE"), 1.608 +('x', True, "VAS", "(2S,4S,5S)-5-AMINO-6-CYCLOHEXYL-4-HYDROXY-2-(1-METHYLETHYL)HEXANOIC ACID"), 1.609 ('x', True, "VDL", "(2R,3R)-2,3-DIAMINOBUTANOIC ACID"), 1.610 ('x', True, "VLL", "(2S)-2,3-DIAMINOBUTANOIC ACID"), 1.611 ('x', True, "VLM", "VALINYLAMINE"), 1.612 ('x', True, "VME", "METHYL L-VALINATE"), 1.613 ('x', True, "VMS", "5'O-[N-(L-VALYL)SULPHAMOYL]ADENOSINE"), 1.614 ('x', True, "VOL", "L-VALINOL"), 1.615 +('x', True, "VSC", "N-[N'-BENZYLOXYCARBONYL-PHENYLALANINYL]-3-AMINO-5-PHENYL-PENTANE-1-SULFONIC ACID PHENYL ESTER"), 1.616 ('x', True, "WFP", "3,5-DIFLUORO-L-PHENYLALANINE"), 1.617 ('x', True, "WRG", "(2S)-2-[[(2S)-2-ACETAMIDO-5-[[N-(METHYLCARBAMOYL)CARBAMIMIDOYL]AMINO]PENTANOYL]-METHYL-AMINO]-3-PHENYL-PROPANOIC ACID"), 1.618 ('x', True, "X97", "3-{4-OXO-4-[(2S)-2-(PYRROLIDIN-1-YLCARBONYL)PYRROLIDIN-1-YL]BUTYL}-5,5-DIPHENYLIMIDAZOLIDINE-2,4-DIONE"), 1.619 @@ -1268,10 +1314,15 @@ 1.620 ('x', True, "ZAE", "N-METHYL-D-PHENYLALANINE"), 1.621 ('x', True, "ZBZ", "S-(PHENYLCARBONYL)-L-CYSTEINE"), 1.622 ('x', True, "ZFB", "(3R)-3-{[(BENZYLOXY)CARBONYL]AMINO}-2-OXO-4-PHENYLBUTANE-1-DIAZONIUM"), 1.623 +('x', True, "ZPR", "N-BENZYLOXYCARBONYL-L-PROLYL-L-PROLINAL"), 1.624 +('x', True, "ZRA", "BENZOYL-ARGININE-ALANINE-FLUORO-METHYL KETONE"), 1.625 ('x', True, "ZRG", "(2S)-2-ACETAMIDO-N-METHYL-5-[[N-(METHYLCARBAMOYL)CARBAMIMIDOYL]AMINO]PENTANAMIDE"), 1.626 ('x', True, "ZU3", "N-[(BENZYLOXY)CARBONYL]-3-[(2,2-DIMETHYLPROPANOYL)AMINO]-L-ALANYL-N-[(1R)-4-OXO-1-{[(3S)-2-OXOPYRROLIDIN-3-YL]METHYL}PENTYL]-L-LEUCINAMIDE"), 1.627 ('x', True, "ZU5", "N-[(BENZYLOXY)CARBONYL]-O-TERT-BUTYL-L-THREONYL-N-[(1R)-4-CYCLOPROPYL-4-OXO-1-{[(3S)-2-OXOPYRROLIDIN-3-YL]METHYL}BUTYL]-L-LEUCINAMIDE"), 1.628 ('x', True, "ZUK", "5-PYRIMIDIN-2-YL-D-NORVALINE"), 1.629 +('x', True, "ZYA", "BENZOYL-TYROSINE-ALANINE-FLUORO-METHYL KETONE"), 1.630 +('x', True, "ZYJ", "(4R)-4-({[(1E)-(3,4-DIMETHOXYPHENYL)METHYLIDENE]AMINO}OXY)-L-PROLINE"), 1.631 +('x', True, "ZYK", "(4R)-4-({[(3,4-DIMETHOXYPHENYL)CARBONYL]AMINO}OXY)-L-PROLINE"), 1.632 ('x', True, "ZZD", "S-TRITYL-L-CYSTEINE"), 1.633 ('x', True, "ZZU", "(2S,3S)-HYDROXYARGININE"), 1.634 ('y', True, "0A1", "O-METHYL-L-TYROSINE"), 1.635 @@ -1325,6 +1376,8 @@ 1.636 ('a', True, "12A", "2-METHYLTHIO-N6-(AMINOCARBONYL-L-THREONYL)-ADENOSINE-5'-MONOPHOSPHATE"), 1.637 ('a', True, "1MA", "6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE"), 1.638 ('a', True, "2MA", "2-METHYLADENOSINE-5'-MONOPHOSPHATE"), 1.639 +('a', True, "3DA", "3'-DEOXYADENOSINE-5'-MONOPHOSPHATE"), 1.640 +('a', True, "5AA", "N6-DIMETHYL-3'-AMINO-ADENOSINE-5'-MONOPHOSPHATE"), 1.641 ('a', True, "5FA", "ADENOSINE-5'-PENTAPHOSPHATE"), 1.642 ('a', True, "6IA", "N6-ISOPENTENYL-ADENOSINE-5'-MONOPHOSPHATE"), 1.643 ('a', True, "6MC", "CIS-N6-METHYL-DEOXY-ADENOSINE-5'-MONOPHOSPHATE"), 1.644 @@ -1340,6 +1393,7 @@ 1.645 ('a', True, "AET", "N-[N-(9-B-D-RIBOFURANOSYLPURIN-6-YL)METHYLCARBAMOYL]THREONINE-5'-MONOPHOSPHATE"), 1.646 ('a', True, "AP7", "N1-PROTONATED ADENOSINE-5'-MONOPHOSPHATE"), 1.647 ('a', True, "AVC", "ADENOSINE-5'-MONOPHOSPHATE-2',3'-VANADATE"), 1.648 +('a', True, "FA2", "5-(6-AMINO-9H-PURIN-9-YL)-4-HYDROXYTETRAHYDROFURAN-3-YL DIHYDROGEN PHOSPHATE"), 1.649 ('a', True, "LCA", "[(1R,3R,4R,7S)-7-HYDROXY-3-(ADENIN-9-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.650 ('a', True, "MA6", "6N-DIMETHYLADENOSINE-5'-MONOPHOSHATE"), 1.651 ('a', True, "MAD", "6-HYDRO-1-METHYLADENOSINE-5'-MONOPHOSPHATE"), 1.652 @@ -1365,6 +1419,8 @@ 1.653 ('c', True, "C2L", "5-METHYL-3'-O-METHOXYETHYL CYTIDINE 5'-MONOPHOSPHATE"), 1.654 ('c', True, "C31", "2'-O-3-AMINOPROPYL CYTIDINE-5'-MONOPHOSPHATE"), 1.655 ('c', True, "C43", "2'-O-METHYOXYETHYL-CYTIDINE-5'-MONOPHOSPHATE"), 1.656 +('c', True, "CAR", "CYTOSINE ARABINOSE-5'-PHOSPHATE"), 1.657 +('c', True, "CB2", "PHOSPHORIC ACID MONO-[5-(4-AMINO-5-BROMO-2-OXO-2H-PYRIMIDIN-1-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL] ESTER"), 1.658 ('c', True, "CBV", "5-BROMOCYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.659 ('c', True, "CCC", "CYTIDINE-5'-PHOSPHATE-2',3'-CYCLIC PHOSPHATE"), 1.660 ('c', True, "CH", "N3-PROTONATED CYTIDINE-5'-MONOPHOSPHATE"), 1.661 @@ -1381,6 +1437,7 @@ 1.662 ('g', True, "0G", "L-GUANOSINE-5'-MONOPHOSPHATE"), 1.663 ('g', True, "1MG", "1N-METHYLGUANOSINE-5'-MONOPHOSPHATE"), 1.664 ('g', True, "2MG", "2N-METHYLGUANOSINE-5'-MONOPHOSPHATE"), 1.665 +('g', True, "5CG", "5'-CHLORO-5'-DEOXY-GUANOSINE"), 1.666 ('g', True, "7MG", "7N-METHYL-8-HYDROGUANOSINE-5'-MONOPHOSPHATE"), 1.667 ('g', True, "CG1", "5'-O-[(R)-HYDROXY(METHOXY)PHOSPHORYL]GUANOSINE"), 1.668 ('g', True, "G25", "GUANOSINE-5'-MONOPHOSPHATE"), 1.669 @@ -1390,11 +1447,13 @@ 1.670 ('g', True, "G7M", "N7-METHYL-GUANOSINE-5'-MONOPHOSPHATE"), 1.671 ('g', True, "GAO", "GUANINE ARABINOSE-5'-PHOSPHATE"), 1.672 ('g', True, "GDP", "GUANOSINE-5'-DIPHOSPHATE"), 1.673 +('g', True, "GDR", "GUANOSINE-5'-DIPHOSPHATE-RHAMNOSE"), 1.674 ('g', True, "GH3", "3'-DEOXY-GUANOSINE-5'-TRIPHOSPHATE"), 1.675 ('g', True, "GOM", "GLUTAMOL-AMP"), 1.676 ('g', True, "GTP", "GUANOSINE-5'-TRIPHOSPHATE"), 1.677 ('g', True, "IG", "ISOGUANOSINE-5'-MONOPHOSPHATE"), 1.678 ('g', True, "KAG", "2'-DEOXY-N-[(1S)-1-METHYL-3-OXOPROPYL]GUANOSINE 5'-PHOSPHATE"), 1.679 +('g', True, "LCG", "[(1R,3R,4R,7S)-7-HYDROXY-3-(GUANIN-9-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.680 ('g', True, "LG", "L-GUANOSINE-5'-MONOPHOSPHATE"), 1.681 ('g', True, "M2G", "N2-DIMETHYLGUANOSINE-5'-MONOPHOSPHATE"), 1.682 ('g', True, "MGV", "P-FLUORO-7-BENZYL GUANINE MONOPHOSPHATE"), 1.683 @@ -1414,12 +1473,16 @@ 1.684 ('n', True, "1PR", "PHOSPHORIC ACID MONO-[5-({[5-CARBAMOYL-3-(5-PHOSPHONOOXY-5-DEOXY-RIBOFURANOSYL)- 3H-IMIDAZOL-4-YLAMINO]-METHYL}-AMINO)-2,3,4-TRIHYDROXY-PENTYL] ESTER"), 1.685 ('n', True, "23G", "GUANOSINE-5'-PHOSPHATE-2',3'-CYCLIC PHOSPHATE"), 1.686 ('n', True, "2SA", "2-[9-(3,4-DIHYDROXY-5-PHOSPHONOOXYMETHYL-TETRAHYDRO-FURAN-2-YL)-9H-PURIN-6-YLAMINO]-SUCCINIC ACID"), 1.687 +('n', True, "3AU", "3-[(3S)-3-AMINO-3-CARBOXYPROPYL]URIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.688 +('n', True, "3MU", "3-METHYLURIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.689 +('n', True, "3TD", "(1S)-1,4-ANHYDRO-1-(3-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-5-O-PHOSPHONO-D-RIBITOL"), 1.690 ('n', True, "4AC", "N(4)-ACETYLCYTIDINE-5'-MONOPHOSPHATE"), 1.691 ('n', True, "4TA", "P1-(5'-ADENOSYL)P4-(5'-(2'-DEOXY-THYMIDYL))TETRAPHOSPHATE"), 1.692 ('n', True, "5CF", "5-FLUOROCYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.693 ('n', True, "6MZ", "N6-METHYLADENOSINE-5'-MONOPHOSPHATE"), 1.694 ('n', True, "ADX", "ADENOSINE-5'-PHOSPHOSULFATE"), 1.695 ('n', True, "BMP", "6-HYDROXYURIDINE-5'-PHOSPHATE"), 1.696 +('n', True, "BMQ", "1-(5'-PHOSPHO-BETA-D-RIBOFURANOSYL)BARBITURIC ACID"), 1.697 ('n', True, "BT5", "BIOTINYL-5-AMP"), 1.698 ('n', True, "CM0", "5-(CARBOXYMETHOXY) URIDINE-5'-MONOPHOSPHATE"), 1.699 ('n', True, "CS8", "3-THIAOCTANOYL-COENZYME A"), 1.700 @@ -1431,11 +1494,17 @@ 1.701 ('n', True, "FAI", "5-(FORMYLAMINO)-1-(5-O-PHOSPHONO-BETA-D-RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXAMIDE"), 1.702 ('n', True, "FMU", "5-FLUORO-5-METHYLURIDINE-5'-MONOPHOSPHATE"), 1.703 ('n', True, "G4P", "GUANOSINE-5',3'-TETRAPHOSPHATE"), 1.704 +('n', True, "GRB", "8-BROMOGUANOSINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.705 +('n', True, "IPN", "2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-5-IODOURACIL"), 1.706 ('n', True, "IRN", "1-(5-O-PHOSPHONO-BETA-D-RIBOFURANOSYL)-1H-IMIDAZOLE"), 1.707 ('n', True, "JW5", "6-(HYDROXYMETHYL)URIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.708 +('n', True, "LCC", "[(1R,3R,4R,7S)-7-HYDROXY-3-(5-METHYLCYTOSIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.709 +('n', True, "LKC", "4-AMINO-1-[(1S,3R,4R,7S)-7-HYDROXY-1-(HYDROXYMETHYL)-2,5-DIOXABICYCLO[2.2.1]HEPT-3-YL]-5-METHYLPYRIMIDIN-2(1H)-ONE"), 1.710 ('n', True, "LMS", "[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDRO-2-FURANYL]METHYL SULFAMATE"), 1.711 +('n', True, "M4C", "N-METHYL-2'-O-METHYLCYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.712 ('n', True, "N", "ANY 5'-MONOPHOSPHATE NUCLEOTIDE"), 1.713 ('n', True, "NF2", "(1S)-1,4-ANHYDRO-1-(2,4-DIFLUORO-5-METHYLPHENYL)-5-O-PHOSPHONO-D-RIBITOL"), 1.714 +('n', True, "O2C", "3'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE"), 1.715 ('n', True, "OAD", "2'-O-ACETYL ADENOSINE-5-DIPHOSPHORIBOSE"), 1.716 ('n', True, "ODP", "4-OXO-NICOTINAMIDE-ADENINE DINUCLEOTIDE PHOSPHATE"), 1.717 ('n', True, "P1P", "3-{[OXIDO(OXO)PHOSPHINO]OXY}PROPAN-1-OLATE"), 1.718 @@ -1445,18 +1514,31 @@ 1.719 ('n', True, "RSP", "4-AMINO-1-(5-O-PHOSPHONO-BETA-D-RIBOFURANOSYL)PYRIMIDINE-2(1H)-THIONE"), 1.720 ('n', True, "RSQ", "5-FORMYLCYTIDINE 5'-(DIHYDROGEN PHOSPHATE)"), 1.721 ('n', True, "RTP", "RIBAVIRIN TRIPHOSPHATE"), 1.722 +('n', True, "RUS", "1-(5-O-PHOSPHONO-BETA-D-RIBOFURANOSYL)-2-SELANYLPYRIMIDIN-4(1H)-ONE"), 1.723 +('n', True, "T2T", "[(2S,3S,5R)-3-[(2S)-3-({[(2R,3S,4R,5R)-3-HYDROXY-4-METHOXY-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)TETRAHYDROFURAN-2-YL]METHYL}AMINO)-2-METHYL-3-OXOPROPYL]-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)TETRAHYDROFURAN-2-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.724 ('n', True, "TAL", "9-(6-DEOXY-ALPHA-L-TALOFURANOSYL)-6-METHYLPURINE"), 1.725 ('n', True, "TLB", "2'-O,3'-C-METHYLENE-ARABINOFURANOSYL-THYMINE-5'-MONOPHOSPHATE"), 1.726 ('n', True, "TYU", "TETRAHYDROURIDINE"), 1.727 ('n', True, "UDP", "URIDINE-5'-DIPHOSPHATE"), 1.728 ('n', True, "ZHP", "(S)-1'-(2',3'-DIHYDROXYPROPYL)-HYDROXYPYRIDONE"), 1.729 +('t', True, "2AT", "2'-O-ALLYL THYMIDINE-5'-MONOPHOSPHATE"), 1.730 +('t', True, "2BT", "2'-O-BUTYL-THYMIDINE"), 1.731 +('t', True, "2GT", "2'-O-PROPARGYL THYMIDINE-5'-MONOPHOSPHATE"), 1.732 +('t', True, "2NT", "2'-O-[2-[HYDROXY(METHYLENEAMINO)OXY]ETHYL THYMIDINE-5'-MONOPHOSPHATE"), 1.733 +('t', True, "2OT", "2'-O-[2-(N,N-DIMETHYLAMINOOXY)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.734 +('t', True, "ATL", "[(1S,3R,4S,7R)-7-HYDROXY-3-(THYMIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.735 +('t', True, "BOE", "2'-O-[2-(BENZYLOXY)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.736 +('t', True, "EIT", "((3R,4R,5R)-4-(2-(1H-IMIDAZOL-1-YL)ETHOXY)-3-HYDROXY-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-TETRAHYDROFURAN-2-YL)METHYL DIHYDROGEN PHOSPHATE"), 1.737 +('t', True, "P2T", "2'-O-PROPYL THYMIDINE-5-MONOPHOSPHATE"), 1.738 ('t', True, "RT", "RIBOSYLTHYMINE-5'-MONOPHOSPHATE"), 1.739 +('t', True, "S2M", "2'-O-[2-(METHOXY)ETHYL]-2-THIOTHYMIDINE-5'-MONOPHOSPHATE"), 1.740 ('t', True, "SMT", "2'-[(METHYLTHIO)ETHYLOXY]-THYMIDINE-5'-MONOPHOSPHATE"), 1.741 ('t', True, "T23", "2'-O-METHYL-3'-METHYL-3'-DEOXY-ARABINOFURANOSYL-THYMINE-5'-PHOSPHATE"), 1.742 ('t', True, "T2S", "THYMIDINE-5'-DITHIOPHOSPHORATE"), 1.743 ('t', True, "T38", "2'-O-ETHOXYMETHYLENE THYMIDINE 5'-MONOPHOSPHATE"), 1.744 ('t', True, "T39", "2'-O-METHOXYETHYLENE THYMIDINE 5'-MONOPHOSPHATE"), 1.745 ('t', True, "T41", "1-(2-O-METHYL-BETA-D-ARABINOFURANOSYL)THYMIDINE 5'-MONOPHOSPHATE"), 1.746 +('t', True, "TFE", "2'-O-[2-(TRIFLUORO)ETHYL] THYMIDINE-5'-MONOPHOSPHATE"), 1.747 ('t', True, "ZTH", "(S)-1'-(2',3'-DIHYDROXYPROPYL)-THYMINE"), 1.748 ('u', True, "0U", "L-URIDINE-5'-MONOPHOSPHATE"), 1.749 ('u', True, "125", "2'-O-FLUOROETHYL-5-METHYL-URIDINE-5'-MONOPHOSPHATE"), 1.750 @@ -1465,6 +1547,7 @@ 1.751 ('u', True, "2AU", "2'-AMINOURIDINE"), 1.752 ('u', True, "2MU", "2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATE"), 1.753 ('u', True, "2OM", "5,6-DIHYDROOROTIDINE 5'-MONOPHOSPHATE"), 1.754 +('u', True, "3ME", "PHOSPHORIC ACID MONO-[4-[2-(2-DIMETHYLAMINO-ETHOXY)-ETHOXY]-3-HYDROXY-5- (5-METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-2-YLMETHYL] ESTER"), 1.755 ('u', True, "4SU", "4-THIOURIDINE-5'-MONOPHOSPHATE"), 1.756 ('u', True, "5BU", "5-BROMO-URIDINE-5'-MONOPHOSPHATE"), 1.757 ('u', True, "5FU", "5-FLUORO-URIDINE-5'-MONOPHOSPHATE"), 1.758 @@ -1473,6 +1556,7 @@ 1.759 ('u', True, "CNU", "5-CYANO-URIDINE-5'-MONOPHOSPHATE"), 1.760 ('u', True, "DHU", "5,6-DIHYDROURIDINE-5'-PHOSPHATE"), 1.761 ('u', True, "FHU", "(5S,6R)-5-FLUORO-6-HYDROXY-PSEUDOURIDINE-5'-MONOPHOSPHATE"), 1.762 +('u', True, "GMU", "2'-O-[(2-GUANIDINIUM)ETHYL]-5-METHYLURIDINE 5'-MONOPHOSPHATE"), 1.763 ('u', True, "H2U", "5,6-DIHYDROURIDINE-5'-MONOPHOSPHATE"), 1.764 ('u', True, "IU", "5-IODOURIDINE-5'-MONOPHOSPHATE"), 1.765 ('u', True, "LHU", "L-URIDINE-5'-MONOPHOSPHATE"), 1.766 @@ -1486,6 +1570,7 @@ 1.767 ('u', True, "SSU", "URIDINE-5'-PHOSPHOROTHIOATE"), 1.768 ('u', True, "SUR", "1-(BETA-D-RIBOFURANOSYL)-2-THIO-URACIL-5'-PHOSPHATE"), 1.769 ('u', True, "T31", "THYMIDINE 5'-MONOTHIOPHOSPHATE"), 1.770 +('u', True, "TLN", "[(1R,3R,4R,7S)-7-HYDROXY-3-(THYMIN-1-YL)-2,5-DIOXABICYCLO[2.2.1]HEPT-1-YL]METHYL DIHYDROGEN PHOSPHATE"), 1.771 ('u', True, "U25", "URIDINE-5'-MONOPHOSPHATE"), 1.772 ('u', True, "U2L", "5-METHYL-3'-O-METHOXYETHYL URIDINE-5'-MONOPHOSPHATE"), 1.773 ('u', True, "U2P", "PHOSPHORIC ACID MONO-[2-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-4-HYDROXY-5-HYDROXYMETHYL-TETRAHYDRO-FURAN-3-YL] ESTER"), 1.774 @@ -1500,6 +1585,7 @@ 1.775 ('u', True, "UR3", "3-METHYLURIDINE-5'-MONOPHOSHATE"), 1.776 ('u', True, "URD", "1-((2R,3R,4S,5R)-TETRAHYDRO-3,4-DIHYDROXY-5-(HYDROXYMETHYL)FURAN-2-YL)PYRIDINE-2,4(1H,3H)-DIONE"), 1.777 ('u', True, "US5", "1-(5-O-PHOSPHONO-BETA-D-RIBOFURANOSYL)-4-SELANYLPYRIMIDIN-2(1H)-ONE"), 1.778 +('u', True, "ZBU", "(S)-1'-(2',3'-DIHYDROXYPROPYL)-5-BROMO-URACIL"), 1.779 ) 1.780 1.781 # vim: set et ts=4 sts=4 sw=4: