| ORN | 表記: | L-ornithine | 組成式: | C5 H12 N2 O2 | SMILES: | O=C(O)C(N)CCCN | InChi: | InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2024-09-27 | 識別子(ID): | L-ornithine |
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| ORQ | 表記: | N~5~-ACETYL-L-ORNITHINE | 組成式: | C7 H14 N2 O3 | SMILES: | O=C(NCCCC(N)C(=O)O)C | InChi: | InChI=1S/C7H14N2O3/c1-5(10)9-4-2-3-6(8)7(11)12/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1 | 定義日: | 2006-02-27 | 最終更新日: | 2024-09-27 | 識別子(ID): | N~5~-acetyl-L-ornithine |
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| 2UC | 表記: | 1-[3-(2-oxoethyl)benzyl]guanidine | 組成式: | C10 H13 N3 O2 | SMILES: | O=CCc1cccc(c1)CNC(=[N@H])N | InChi: | InChI=1S/C10H13N3O2/c11-10(12)13-6-8-3-1-2-7(4-8)5-9(14)15/h1-4H,5-6H2,(H,14,15)(H4,11,12,13) | 定義日: | 2014-02-07 | 最終更新日: | 2024-09-27 | 公開日: | 2014-04-09 | 識別子(ID): | 1-[3-(2-oxoethyl)benzyl]guanidine |
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| ORT | 表記: | (4~{S})-4-azanyl-5-oxidanylidene-pentanehydrazide | 組成式: | C5 H11 N3 O3 | SMILES: | NNC(=O)CC[CH](N)C(O)=O | InChi: | InChI=1S/C5H11N3O3/c6-3(5(10)11)1-2-4(9)8-7/h3H,1-2,6-7H2,(H,8,9)(H,10,11)/t3-/m0/s1 | 定義日: | 2020-04-01 | 最終更新日: | 2024-09-27 | 公開日: | 2020-07-01 | 識別子(ID): | (2~{S})-2-azanyl-5-diazanyl-5-oxidanylidene-pentanoic acid |
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| 2UE | 表記: | 1-[4-(2-oxoethyl)benzyl]guanidine | 組成式: | C10 H13 N3 O | SMILES: | C(c1ccc(cc1)CNC(N)=[N@H])C=O | InChi: | InChI=1S/C10H13N3O/c11-10(12)13-7-9-3-1-8(2-4-9)5-6-14/h1-4,6H,5,7H2,(H4,11,12,13) | 定義日: | 2015-06-22 | 最終更新日: | 2024-09-27 | 公開日: | 2015-07-01 | 識別子(ID): | 1-[4-(2-oxoethyl)benzyl]guanidine |
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| 2UH | 表記: | N-[3-(propanoylamino)propyl]guanosine 5'-(trihydrogen diphosphate) | 組成式: | C16 H26 N6 O12 P2 | SMILES: | O=P(O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(NCCCNC(=O)CC)NC1=O)C(O)C3O | InChi: | InChI=1S/C16H26N6O12P2/c1-2-9(23)17-4-3-5-18-16-20-13-10(14(26)21-16)19-7-22(13)15-12(25)11(24)8(33-15)6-32-36(30,31)34-35(27,28)29/h7-8,11-12,15,24-25H,2-6H2,1H3,(H,17,23)(H,30,31)(H2,27,28,29)(H2,18,20,21,26)/t8-,11-,12-,15-/m1/s1 | 定義日: | 2014-05-08 | 最終更新日: | 2024-09-27 | 公開日: | 2014-05-28 | 識別子(ID): | N-[3-(propanoylamino)propyl]guanosine 5'-(trihydrogen diphosphate) |
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| ORW | 表記: | 1-[(2~{S})-1-[[iminomethyl(methyl)amino]-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(phenylmethyl)urea | 組成式: | C17 H27 N5 O2 | SMILES: | CC(C)C[CH](NC(=O)NCc1ccccc1)C(=O)N(C)N(C)C=N | InChi: | InChI=1S/C17H27N5O2/c1-13(2)10-15(16(23)22(4)21(3)12-18)20-17(24)19-11-14-8-6-5-7-9-14/h5-9,12-13,15,18H,10-11H2,1-4H3,(H2,19,20,24)/b18-12-/t15-/m0/s1 | 定義日: | 2020-04-01 | 最終更新日: | 2024-09-27 | 公開日: | 2020-12-16 | 識別子(ID): | 1-[(2~{S})-1-[[iminomethyl(methyl)amino]-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(phenylmethyl)urea |
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| ORX | 表記: | N~2~-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-D-ORNITHINE | 組成式: | C13 H22 N3 O7 P | SMILES: | O=C(O)C(NCc1c(cnc(c1O)C)COP(=O)(O)O)CCCN | InChi: | InChI=1S/C13H22N3O7P/c1-8-12(17)10(6-16-11(13(18)19)3-2-4-14)9(5-15-8)7-23-24(20,21)22/h5,11,16-17H,2-4,6-7,14H2,1H3,(H,18,19)(H2,20,21,22)/t11-/m1/s1 | 定義日: | 2003-02-10 | 最終更新日: | 2024-09-27 | 識別子(ID): | N~2~-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-D-ornithine |
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| 2UJ | 表記: | N-[3-(propanoylamino)propyl]guanosine 5'-(tetrahydrogen triphosphate) | 組成式: | C16 H27 N6 O15 P3 | SMILES: | O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n1cnc2c1NC(=NC2=O)NCCCNC(=O)CC)C(O)C3O | InChi: | InChI=1S/C16H27N6O15P3/c1-2-9(23)17-4-3-5-18-16-20-13-10(14(26)21-16)19-7-22(13)15-12(25)11(24)8(35-15)6-34-39(30,31)37-40(32,33)36-38(27,28)29/h7-8,11-12,15,24-25H,2-6H2,1H3,(H,17,23)(H,30,31)(H,32,33)(H2,27,28,29)(H2,18,20,21,26)/t8-,11-,12-,15-/m1/s1 | 定義日: | 2014-05-08 | 最終更新日: | 2024-09-27 | 公開日: | 2014-05-28 | 識別子(ID): | N-[3-(propanoylamino)propyl]guanosine 5'-(tetrahydrogen triphosphate) |
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| 2UK | 表記: | 5'-O-[(R)-hydroxy{[(S)-hydroxy(phosphonoamino)phosphoryl]oxy}phosphoryl]-N-[3-(propanoylamino)propyl]guanosine | 組成式: | C16 H28 N7 O14 P3 | SMILES: | O=P(O)(O)NP(=O)(O)OP(=O)(O)OCC3OC(n1cnc2c1NC(=NC2=O)NCCCNC(=O)CC)C(O)C3O | InChi: | InChI=1S/C16H28N7O14P3/c1-2-9(24)17-4-3-5-18-16-20-13-10(14(27)21-16)19-7-23(13)15-12(26)11(25)8(36-15)6-35-40(33,34)37-39(31,32)22-38(28,29)30/h7-8,11-12,15,25-26H,2-6H2,1H3,(H,17,24)(H,33,34)(H2,18,20,21,27)(H4,22,28,29,30,31,32)/t8-,11-,12-,15-/m1/s1 | 定義日: | 2014-05-08 | 最終更新日: | 2024-09-27 | 公開日: | 2014-05-28 | 識別子(ID): | 5'-O-[(R)-hydroxy{[(S)-hydroxy(phosphonoamino)phosphoryl]oxy}phosphoryl]-N-[3-(propanoylamino)propyl]guanosine |
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| 2UL | 表記: | 3-[(2R)-2-{[(2R)-2-amino-2-phenylacetyl]amino}-2-(dihydroxyboranyl)ethyl]benzoic acid | 組成式: | C17 H19 B N2 O5 | SMILES: | O=C(O)c1cccc(c1)CC(B(O)O)NC(=O)C(N)c2ccccc2 | InChi: | InChI=1S/C17H19BN2O5/c19-15(12-6-2-1-3-7-12)16(21)20-14(18(24)25)10-11-5-4-8-13(9-11)17(22)23/h1-9,14-15,24-25H,10,19H2,(H,20,21)(H,22,23)/t14-,15+/m0/s1 | 定義日: | 2014-02-10 | 最終更新日: | 2024-09-27 | 公開日: | 2015-05-20 | 識別子(ID): | 3-[(2R)-2-{[(2R)-2-amino-2-phenylacetyl]amino}-2-(dihydroxyboranyl)ethyl]benzoic acid |
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| 2UQ | 表記: | N-benzyl-2-[(Z)-iminomethyl]pyrimidine-5-carboxamide | 組成式: | C13 H12 N4 O | SMILES: | O=C(c1cnc(nc1)C=[N@H])NCc2ccccc2 | InChi: | InChI=1S/C13H12N4O/c14-6-12-15-8-11(9-16-12)13(18)17-7-10-4-2-1-3-5-10/h1-6,8-9,14H,7H2,(H,17,18)/b14-6+ | 定義日: | 2014-05-08 | 最終更新日: | 2024-09-27 | 公開日: | 2014-09-10 | 識別子(ID): | N-benzyl-2-[(E)-iminomethyl]pyrimidine-5-carboxamide |
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| OSE | 表記: | O-SULFO-L-SERINE | 組成式: | C3 H7 N O6 S | SMILES: | O=S(=O)(O)OCC(C(=O)O)N | InChi: | InChI=1S/C3H7NO6S/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1 | 定義日: | 2005-02-24 | 最終更新日: | 2024-09-27 | 識別子(ID): | O-sulfo-L-serine |
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| 2V5 | 表記: | N-[(2S)-5-(carbamimidamidooxy)-1-oxo-1-{[(1E,3S)-5-phenyl-1-(phenylsulfonyl)pent-1-en-3-yl]amino}pentan-2-yl]-4-methylpiperazine-1-carboxamide | 組成式: | C29 H41 N7 O5 S | SMILES: | O=C(N1CCN(C)CC1)NC(C(=O)NC(/C=C/S(=O)(=O)c2ccccc2)CCc3ccccc3)CCCONC(=[N@H])N | InChi: | InChI=1S/C29H41N7O5S/c1-35-17-19-36(20-18-35)29(38)33-26(13-8-21-41-34-28(30)31)27(37)32-24(15-14-23-9-4-2-5-10-23)16-22-42(39,40)25-11-6-3-7-12-25/h2-7,9-12,16,22,24,26H,8,13-15,17-21H2,1H3,(H,32,37)(H,33,38)(H4,30,31,34)/t24-,26-/m0/s1 | 定義日: | 2014-05-09 | 最終更新日: | 2024-09-27 | 公開日: | 2014-11-12 | 識別子(ID): | N-[(2S)-5-(carbamimidamidooxy)-1-oxo-1-{[(1E,3S)-5-phenyl-1-(phenylsulfonyl)pent-1-en-3-yl]amino}pentan-2-yl]-4-methylpiperazine-1-carboxamide |
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| OSL | 表記: | (2R)-2-hydroxy-3-(sulfooxy)propanoic acid | 組成式: | C3 H6 O7 S | SMILES: | O=S(=O)(OCC(O)C(=O)O)O | InChi: | InChI=1S/C3H6O7S/c4-2(3(5)6)1-10-11(7,8)9/h2,4H,1H2,(H,5,6)(H,7,8,9)/t2-/m1/s1 | 定義日: | 2010-11-10 | 最終更新日: | 2024-09-27 | 識別子(ID): | (2R)-2-hydroxy-3-(sulfooxy)propanoic acid |
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| 2V7 | 表記: | (1S,2S)-1-(6-methoxynaphthalen-2-yl)propane-1,2-diol | 組成式: | C14 H16 O3 | SMILES: | OC(C)C(O)c1ccc2c(c1)ccc(OC)c2 | InChi: | InChI=1S/C14H16O3/c1-9(15)14(16)12-4-3-11-8-13(17-2)6-5-10(11)7-12/h3-9,14-16H,1-2H3/t9-,14+/m0/s1 | 別名: | (6-methoxynaphthalen-2-yl)(oxiran-2-yl)methanol, bound form | 定義日: | 2014-02-20 | 最終更新日: | 2024-09-27 | 公開日: | 2014-03-05 | 識別子(ID): | (1S,2S)-1-(6-methoxynaphthalen-2-yl)propane-1,2-diol |
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| OSS | 表記: | 6-(HYDROXYETHYLDITHIO)-8-(AMINOMETHYLTHIO)OCTANOIC ACID | 組成式: | C11 H23 N O3 S3 | SMILES: | O=C(O)CCCCC(SSCCO)CCSCN | InChi: | InChI=1S/C11H23NO3S3/c12-9-16-7-5-10(18-17-8-6-13)3-1-2-4-11(14)15/h10,13H,1-9,12H2,(H,14,15)/t10-/m0/s1 | 定義日: | 1999-07-08 | 最終更新日: | 2024-09-27 | 識別子(ID): | (6S)-8-[(aminomethyl)sulfanyl]-6-[(2-hydroxyethyl)disulfanyl]octanoic acid |
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| OT0 | 表記: | 2-chloranyl-~{N}-[[1-[(2~{S},6~{R})-4-[(4-chlorophenyl)amino]-2,6-dimethyl-oxan-4-yl]carbonylpiperidin-4-yl]methyl]ethanamide | 組成式: | C22 H31 Cl2 N3 O3 | SMILES: | C[CH]1C[C](C[CH](C)O1)(Nc2ccc(Cl)cc2)C(=O)N3CC[CH](CC3)CNC(=O)CCl | InChi: | InChI=1S/C22H31Cl2N3O3/c1-15-11-22(12-16(2)30-15,26-19-5-3-18(24)4-6-19)21(29)27-9-7-17(8-10-27)14-25-20(28)13-23/h3-6,15-17,26H,7-14H2,1-2H3,(H,25,28)/t15-,16+,22+ | 別名: | RU78299 | 定義日: | 2022-09-19 | 最終更新日: | 2024-09-27 | 公開日: | 2023-09-20 | 識別子(ID): | 2-chloranyl-~{N}-[[1-[(2~{S},6~{R})-4-[(4-chlorophenyl)amino]-2,6-dimethyl-oxan-4-yl]carbonylpiperidin-4-yl]methyl]ethanamide |
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| 2VS | 表記: | (2Z,4E)-2-hydroxy-6-oxohexa-2,4-dienoic acid | 組成式: | C6 H6 O4 | SMILES: | O=C(O)C(O)=CC=CC=O | InChi: | InChI=1S/C6H6O4/c7-4-2-1-3-5(8)6(9)10/h1-4,8H,(H,9,10)/b2-1+,5-3- | 定義日: | 2014-02-26 | 最終更新日: | 2024-09-27 | 公開日: | 2014-12-24 | 識別子(ID): | (2Z,4E)-2-hydroxy-6-oxohexa-2,4-dienoic acid |
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| OTH | 表記: | N,O-dimethyl-L-threonine | 組成式: | C6 H13 N O3 | SMILES: | O=C(O)C(NC)C(OC)C | InChi: | InChI=1S/C6H13NO3/c1-4(10-3)5(7-2)6(8)9/h4-5,7H,1-3H3,(H,8,9)/t4-,5+/m1/s1 | 定義日: | 2010-05-20 | 最終更新日: | 2024-09-27 | 識別子(ID): | N,O-dimethyl-L-threonine |
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| 2W7 | 表記: | N-{2-oxo-2-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-ylamino]ethyl}-2-sulfanylbenzamide | 組成式: | C19 H24 N2 O2 S | SMILES: | O=C(c1ccccc1S)NCC(=O)NC24CC3CC(CC(C2)C3)C4 | InChi: | InChI=1S/C19H24N2O2S/c22-17(11-20-18(23)15-3-1-2-4-16(15)24)21-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14,24H,5-11H2,(H,20,23)(H,21,22)/t12-,13+,14-,19- | 定義日: | 2014-03-06 | 最終更新日: | 2024-09-27 | 公開日: | 2014-11-19 | 識別子(ID): | N-{2-oxo-2-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-ylamino]ethyl}-2-sulfanylbenzamide |
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| OTO | 表記: | 1-cyclopropylcarbonylpyrazolo[4,3-c]pyridine-3-carbonitrile | 組成式: | C11 H8 N4 O | SMILES: | O=C(C1CC1)n2nc(C#N)c3cnccc23 | InChi: | InChI=1S/C11H8N4O/c12-5-9-8-6-13-4-3-10(8)15(14-9)11(16)7-1-2-7/h3-4,6-7H,1-2H2 | 定義日: | 2022-09-20 | 最終更新日: | 2024-09-27 | 公開日: | 2023-09-20 | 識別子(ID): | 1-cyclopropylcarbonylpyrazolo[4,3-c]pyridine-3-carbonitrile |
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| OTT | 表記: | (2E,4E,6E)-octa-2,4,6-trienoic acid | 組成式: | C8 H10 O2 | SMILES: | O=C(O)C=CC=CC=CC | InChi: | InChI=1S/C8H10O2/c1-2-3-4-5-6-7-8(9)10/h2-7H,1H3,(H,9,10)/b3-2+,5-4+,7-6+ | 別名: | 2,4,6-OCTATRIENOIC ACID | 定義日: | 2009-12-08 | 最終更新日: | 2024-09-27 | 識別子(ID): | (2E,4E,6E)-octa-2,4,6-trienoic acid |
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| OTY | 表記: | 2-hydroxy-L-tyrosine | 組成式: | C9 H11 N O4 | SMILES: | O=C(O)C(N)Cc1ccc(O)cc1O | InChi: | InChI=1S/C9H11NO4/c10-7(9(13)14)3-5-1-2-6(11)4-8(5)12/h1-2,4,7,11-12H,3,10H2,(H,13,14)/t7-/m0/s1 | 定義日: | 2006-11-21 | 最終更新日: | 2024-09-27 | 識別子(ID): | 2-hydroxy-L-tyrosine |
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| OTZ | 表記: | 2-[2-(aminomethyl)-1,3-oxazol-4-yl]-1,3-thiazole-4-carboxylic acid | 組成式: | C8 H7 N3 O3 S | SMILES: | NCc1occ(n1)c2scc(n2)C(O)=O | InChi: | InChI=1S/C8H7N3O3S/c9-1-6-10-4(2-14-6)7-11-5(3-15-7)8(12)13/h2-3H,1,9H2,(H,12,13) | 定義日: | 2018-06-04 | 最終更新日: | 2024-09-27 | 公開日: | 2019-01-30 | 識別子(ID): | 2-[2-(aminomethyl)-1,3-oxazol-4-yl]-1,3-thiazole-4-carboxylic acid |
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