| OMC | Name: | O2'-METHYLYCYTIDINE-5'-MONOPHOSPHATE | Formula: | C10 H16 N3 O8 P | SMILES: | O=C1N=C(N)C=CN1C2OC(C(O)C2OC)COP(=O)(O)O | InChi: | InChI=1S/C10H16N3O8P/c1-19-8-7(14)5(4-20-22(16,17)18)21-9(8)13-3-2-6(11)12-10(13)15/h2-3,5,7-9,14H,4H2,1H3,(H2,11,12,15)(H2,16,17,18)/t5-,7-,8-,9-/m1/s1 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 2'-O-methylcytidine 5'-(dihydrogen phosphate) |
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| ACA | Name: | 6-AMINOHEXANOIC ACID | Formula: | C6 H13 N O2 | SMILES: | O=C(O)CCCCCN | InChi: | InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9) | Synonyms: | AMINOCAPROIC ACID | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 6-aminohexanoic acid |
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| OMG | Name: | O2'-METHYLGUANOSINE-5'-MONOPHOSPHATE | Formula: | C11 H16 N5 O8 P | SMILES: | O=C1c2ncn(c2N=C(N)N1)C3OC(C(O)C3OC)COP(=O)(O)O | InChi: | InChI=1S/C11H16N5O8P/c1-22-7-6(17)4(2-23-25(19,20)21)24-10(7)16-3-13-5-8(16)14-11(12)15-9(5)18/h3-4,6-7,10,17H,2H2,1H3,(H2,19,20,21)(H3,12,14,15,18)/t4-,6-,7-,10-/m1/s1 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 2'-O-methylguanosine 5'-(dihydrogen phosphate) |
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| OML | Name: | (1R,2S,3R,4R)-5-fluoro-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol | Formula: | C7 H11 F O5 | SMILES: | OC1C(CO)=C(F)C(O)C(O)C1O | InChi: | InChI=1S/C7H11FO5/c8-3-2(1-9)4(10)6(12)7(13)5(3)11/h4-7,9-13H,1H2/t4-,5+,6+,7+/m1/s1 | Synonyms: | C5a-fluoro-valienide | Definition date: | 2022-05-12 | Last modified: | 2024-09-27 | Release date: | 2023-04-05 | Identifier: | (1R,2S,3R,4R)-5-fluoro-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol |
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| ACN | Name: | ACETONE | Formula: | C3 H6 O | SMILES: | O=C(C)C | InChi: | InChI=1S/C3H6O/c1-3(2)4/h1-2H3 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | propan-2-one |
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| OMU | Name: | O2'-METHYLURIDINE 5'-MONOPHOSPHATE | Formula: | C10 H15 N2 O9 P | SMILES: | O=C1NC(=O)N(C=C1)C2OC(C(O)C2OC)COP(=O)(O)O | InChi: | InChI=1S/C10H15N2O9P/c1-19-8-7(14)5(4-20-22(16,17)18)21-9(8)12-3-2-6(13)11-10(12)15/h2-3,5,7-9,14H,4H2,1H3,(H,11,13,15)(H2,16,17,18)/t5-,7-,8-,9-/m1/s1 | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 2'-O-methyluridine 5'-(dihydrogen phosphate) |
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| OMX | Name: | (betaR)-beta-hydroxy-L-Tyrosine | Formula: | C9 H11 N O4 | SMILES: | O=C(O)C(N)C(O)c1ccc(O)cc1 | InChi: | InChI=1S/C9H11NO4/c10-7(9(13)14)8(12)5-1-3-6(11)4-2-5/h1-4,7-8,11-12H,10H2,(H,13,14)/t7-,8+/m0/s1 | Definition date: | 2010-08-10 | Last modified: | 2024-09-27 | Identifier: | (betaR)-beta-hydroxy-L-tyrosine |
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| OMY | Name: | (betaR)-3-chloro-beta-hydroxy-L-tyrosine | Formula: | C9 H10 Cl N O4 | SMILES: | Clc1cc(ccc1O)C(O)C(C(=O)O)N | InChi: | InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8+/m0/s1 | Definition date: | 2009-03-27 | Last modified: | 2024-09-27 | Identifier: | (betaR)-3-chloro-beta-hydroxy-L-tyrosine |
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| OMZ | Name: | (betaR)-3-CHLORO-BETA-HYDROXY-D-TYROSINE | Formula: | C9 H10 Cl N O4 | SMILES: | Clc1cc(ccc1O)C(O)C(C(=O)O)N | InChi: | InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8-/m1/s1 | Definition date: | 2010-08-06 | Last modified: | 2024-09-27 | Identifier: | (betaR)-3-chloro-beta-hydroxy-D-tyrosine |
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| ACY | Name: | ACETIC ACID | Formula: | C2 H4 O2 | SMILES: | O=C(O)C | InChi: | InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4) | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | acetic acid |
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| ONK | Name: | N-hexanoyl-L-valyl-N~1~-[(3S,4S)-3-hydroxy-2,6-dimethylhept-1-en-4-yl]-N~5~,N~5~-dimethyl-L-glutamamide | Formula: | C27 H50 N4 O5 | SMILES: | O=C(NC(CC(C)C)C(O)C(=C)C)C(NC(=O)C(NC(=O)CCCCC)C(C)C)CCC(=O)N(C)C | InChi: | InChI=1S/C27H50N4O5/c1-10-11-12-13-22(32)30-24(18(4)5)27(36)28-20(14-15-23(33)31(8)9)26(35)29-21(16-17(2)3)25(34)19(6)7/h17-18,20-21,24-25,34H,6,10-16H2,1-5,7-9H3,(H,28,36)(H,29,35)(H,30,32)/t20-,21-,24-,25-/m0/s1 | Synonyms: | vinylketone carmaphycin analogue VNK1, single bound form | Definition date: | 2012-11-01 | Last modified: | 2024-09-27 | Release date: | 2014-01-29 | Identifier: | N-hexanoyl-L-valyl-N~1~-[(3S,4S)-3-hydroxy-2,6-dimethylhept-1-en-4-yl]-N~5~,N~5~-dimethyl-L-glutamamide |
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| ADM | Name: | ADAMANTANE | Formula: | C10 H16 | SMILES: | C1C2CC3CC1CC(C2)C3 | InChi: | InChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+ | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | tricyclo[3.3.1.1~3,7~]decane |
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| ADT | Name: | 3'-DEOXY-3'-ACETAMIDO-THYMIDINE | Formula: | C12 H17 N3 O5 | SMILES: | O=C1NC(=O)N(C=C1C)C2OC(C(NC(=O)C)C2)CO | InChi: | InChI=1S/C12H17N3O5/c1-6-4-15(12(19)14-11(6)18)10-3-8(13-7(2)17)9(5-16)20-10/h4,8-10,16H,3,5H2,1-2H3,(H,13,17)(H,14,18,19)/t8-,9+,10+/m0/s1 | Synonyms: | ((((3'-DEOXY-3'-THYMIDINYL)-AMINO)CARBONYL)METHYL) | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 3'-(acetylamino)-3'-deoxythymidine |
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| OO1 | Name: | (4-methylphenyl)carbamic acid | Formula: | C8 H9 N O2 | SMILES: | C(O)(=O)Nc1ccc(cc1)C | InChi: | InChI=1S/C8H9NO2/c1-6-2-4-7(5-3-6)9-8(10)11/h2-5,9H,1H3,(H,10,11) | Definition date: | 2019-07-01 | Last modified: | 2024-09-27 | Release date: | 2019-11-06 | Identifier: | (4-methylphenyl)carbamic acid |
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| OOG | Name: | 2-OXOADIPIC ACID | Formula: | C6 H8 O5 | SMILES: | O=C(C(=O)O)CCCC(=O)O | InChi: | InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11) | Definition date: | 2015-01-21 | Last modified: | 2024-09-27 | Release date: | 2015-01-28 | Identifier: | 2-oxohexanedioic acid |
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| OOL | Name: | (E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine | Formula: | C7 H9 N3 O2 | SMILES: | N=Cc1nc(OC)cc(OC)n1 | InChi: | InChI=1S/C7H9N3O2/c1-11-6-3-7(12-2)10-5(4-8)9-6/h3-4,8H,1-2H3/b8-4+ | Definition date: | 2023-08-17 | Last modified: | 2024-09-27 | Release date: | 2023-11-08 | Identifier: | (E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine |
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| AEM | Name: | 2-AMINOETHANIMIDIC ACID | Formula: | C2 H6 N2 | SMILES: | [N@H]=CCN | InChi: | InChI=1S/C2H6N2/c3-1-2-4/h1,3H,2,4H2/b3-1+ | Definition date: | 2001-09-25 | Last modified: | 2024-09-27 | Identifier: | (2E)-2-iminoethanamine |
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| AEQ | Name: | methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate | Formula: | C14 H17 N O3 | SMILES: | CCC(=O)N1CCCc2cc(ccc12)C(=O)OC | InChi: | InChI=1S/C14H17NO3/c1-3-13(16)15-8-4-5-10-9-11(14(17)18-2)6-7-12(10)15/h6-7,9H,3-5,8H2,1-2H3 | Definition date: | 2017-08-18 | Last modified: | 2024-09-27 | Release date: | 2018-03-14 | Identifier: | methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate |
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| OP0 | Name: | (2S,5R)-N-(2-aminoethoxy)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide | Formula: | C9 H18 N4 O7 S | SMILES: | O=CN1C(C(=O)NOCCN)CCC(NOS(=O)(=O)O)C1 | InChi: | InChI=1S/C9H18N4O7S/c10-3-4-19-12-9(15)8-2-1-7(5-13(8)6-14)11-20-21(16,17)18/h6-8,11H,1-5,10H2,(H,12,15)(H,16,17,18)/t7-,8+/m1/s1 | Definition date: | 2014-12-09 | Last modified: | 2024-09-27 | Release date: | 2015-07-01 | Identifier: | (2S,5R)-N-(2-aminoethoxy)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide |
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| AES | Name: | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | Formula: | C8 H10 F N O2 S | SMILES: | O=S(F)(=O)c1ccc(cc1)CCN | InChi: | InChI=1S/C8H10FNO2S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2 | Synonyms: | AEBSF | Definition date: | 2005-09-27 | Last modified: | 2024-09-27 | Identifier: | 4-(2-aminoethyl)benzenesulfonyl fluoride |
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| OPE | Name: | PHOSPHORIC ACID MONO-(2-AMINO-ETHYL) ESTER | Formula: | C2 H8 N O4 P | SMILES: | O=P(O)(O)OCCN | InChi: | InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6) | Synonyms: | COLAMINE PHOSPHORIC ACID | Definition date: | 1999-07-08 | Last modified: | 2024-09-27 | Identifier: | 2-aminoethyl dihydrogen phosphate |
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| OPP | Name: | 1-[PYRROL-1-YL-2,5-DIONE-METHOXYMETHYL]-PYRROLE-2,5-DIONE | Formula: | C10 H8 N2 O5 | SMILES: | O=C1N(C(=O)C=C1)COCN2C(=O)C=CC2=O | InChi: | InChI=1S/C10H8N2O5/c13-7-1-2-8(14)11(7)5-17-6-12-9(15)3-4-10(12)16/h1-4H,5-6H2 | Definition date: | 2001-09-06 | Last modified: | 2024-09-27 | Identifier: | 1,1'-(oxydimethanediyl)bis(1H-pyrrole-2,5-dione) |
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| OQ2 | Name: | ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{R})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide | Formula: | C33 H40 F3 N7 O3 | SMILES: | CCN1CCN(CC1)Cc2ccc(NC(=O)c3ccc(C)c(Oc4ccnc(N[CH]5CCN(C5)C(=O)CC)n4)c3)cc2C(F)(F)F | InChi: | InChI=1S/C33H40F3N7O3/c1-4-30(44)43-13-11-26(21-43)39-32-37-12-10-29(40-32)46-28-18-23(7-6-22(28)3)31(45)38-25-9-8-24(27(19-25)33(34,35)36)20-42-16-14-41(5-2)15-17-42/h6-10,12,18-19,26H,4-5,11,13-17,20-21H2,1-3H3,(H,38,45)(H,37,39,40)/t26-/m1/s1 | Definition date: | 2020-03-27 | Last modified: | 2024-09-27 | Release date: | 2020-08-12 | Identifier: | ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{R})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide |
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| OQ8 | Name: | ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide | Formula: | C33 H40 F3 N7 O3 | SMILES: | CCN1CCN(CC1)Cc2ccc(NC(=O)c3ccc(C)c(Oc4ccnc(N[CH]5CCN(C5)C(=O)CC)n4)c3)cc2C(F)(F)F | InChi: | InChI=1S/C33H40F3N7O3/c1-4-30(44)43-13-11-26(21-43)39-32-37-12-10-29(40-32)46-28-18-23(7-6-22(28)3)31(45)38-25-9-8-24(27(19-25)33(34,35)36)20-42-16-14-41(5-2)15-17-42/h6-10,12,18-19,26H,4-5,11,13-17,20-21H2,1-3H3,(H,38,45)(H,37,39,40)/t26-/m0/s1 | Definition date: | 2020-03-27 | Last modified: | 2024-09-27 | Release date: | 2020-08-12 | Identifier: | ~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide |
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| OQB | Name: | 4-OXO-3-[(6-{[4-(QUINOXALIN-2-YLAMINO)-BENZOYLAMINO]-METHYL}-PYRIDINE-3-CARBONYL)-AMINO]-BUTYRIC ACID | Formula: | C26 H22 N6 O5 | SMILES: | O=C(O)CC(C=O)NC(=O)c1cnc(cc1)CNC(=O)c4ccc(Nc2nc3c(nc2)cccc3)cc4 | InChi: | InChI=1S/C26H22N6O5/c33-15-20(11-24(34)35)31-26(37)17-7-10-19(27-12-17)13-29-25(36)16-5-8-18(9-6-16)30-23-14-28-21-3-1-2-4-22(21)32-23/h1-10,12,14-15,20H,11,13H2,(H,29,36)(H,30,32)(H,31,37)(H,34,35)/t20-/m0/s1 | Definition date: | 2004-01-09 | Last modified: | 2024-09-27 | Identifier: | (3S)-4-oxo-3-[({6-[({[4-(quinoxalin-2-ylamino)phenyl]carbonyl}amino)methyl]pyridin-3-yl}carbonyl)amino]butanoic acid |
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