 | | CLU | | 表記: | 2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINE | | 組成式: | C9 H9 Cl2 N3 | | SMILES: | Clc2c(N=C1/NCCN1)c(Cl)ccc2 | | InChi: | InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14) | | 別名: | CLONIDINE | | 定義日: | 2007-05-01 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 2,6-dichloro-N-imidazolidin-2-ylideneaniline |
|
 | | CN3 | | 表記: | (2R,5S,11R,14R)-5,8,11-trihydroxy-2-(nonanoyloxy)-5,11-dioxido-16-oxo-14-[(propanoyloxy)methyl]-4,6,10,12,15-pentaoxa-5,11-diphosphanonadec-1-yl undecanoate | | 組成式: | C36 H68 O17 P2 | | SMILES: | O=C(OC(COP(=O)(OCC(O)COP(=O)(O)OCC(OC(=O)CCC)COC(=O)CC)O)COC(=O)CCCCCCCCCC)CCCCCCCC | | InChi: | InChI=1S/C36H68O17P2/c1-5-9-11-13-15-16-18-19-22-34(39)47-27-32(53-36(41)23-20-17-14-12-10-6-2)29-51-55(44,45)49-25-30(37)24-48-54(42,43)50-28-31(26-46-33(38)8-4)52-35(40)21-7-3/h30-32,37H,5-29H2,1-4H3,(H,42,43)(H,44,45)/t30-,31-,32-/m1/s1 | | 別名: | CARDIOLIPIN | | 定義日: | 2008-04-30 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (2R,5S,11R,14R)-5,8,11-trihydroxy-2-(nonanoyloxy)-5,11-dioxido-16-oxo-14-[(propanoyloxy)methyl]-4,6,10,12,15-pentaoxa-5,11-diphosphanonadec-1-yl undecanoate |
|
 | | CN5 | | 表記: | (5S,11R)-5,8,11-trihydroxy-5,11-dioxido-17-oxo-4,6,10,12,16-pentaoxa-5,11-diphosphaoctadec-1-yl pentadecanoate | | 組成式: | C26 H52 O13 P2 | | SMILES: | O=C(OCCCOP(=O)(OCC(O)COP(=O)(O)OCCCOC(=O)C)O)CCCCCCCCCCCCCC | | InChi: | InChI=1S/C26H52O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-26(29)35-19-16-21-37-41(32,33)39-23-25(28)22-38-40(30,31)36-20-15-18-34-24(2)27/h25,28H,3-23H2,1-2H3,(H,30,31)(H,32,33)/t25-/m0/s1 | | 別名: | CARDIOLIPIN | | 定義日: | 2008-04-28 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (5S,11R)-5,8,11-trihydroxy-5,11-dioxido-17-oxo-4,6,10,12,16-pentaoxa-5,11-diphosphaoctadec-1-yl pentadecanoate |
|
 | | CNQ | | 表記: | 3-(4-CHLOROPHENYL)QUINOXALINE-5-CARBOXAMIDE | | 組成式: | C15 H10 Cl N3 O | | SMILES: | Clc3ccc(c1nc2c(cccc2nc1)C(=O)N)cc3 | | InChi: | InChI=1S/C15H10ClN3O/c16-10-6-4-9(5-7-10)13-8-18-12-3-1-2-11(15(17)20)14(12)19-13/h1-8H,(H2,17,20) | | 別名: | 2-(4-CHLOROPHENYL)-5-QUINOXALINECARBOXAMIDE | | 定義日: | 2004-08-25 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 3-(4-chlorophenyl)quinoxaline-5-carboxamide |
|
 | | CNY | | 表記: | 13,15-DIAMINO-2-(AMINOMETHYL)-3,4,9,12-TETRAHYDROXYHEXADECAHYDRO-2H-7,10-EPOXYPYRANO[2,3-B][1,10,4]BENZODIOXAZACYCLODODECIN-8-YL 2,6-DIAMINO-2,6-DIDEOXYHEXOPYRANOSIDE | | 組成式: | C23 H44 N6 O12 | | SMILES: | O1C(CN)C(O)C(O)C2NCC5OC(OC3C(OC12)C(N)CC(N)C3O)C(O)C5OC4OC(CN)C(O)C(O)C4N | | InChi: | InChI=1S/C23H44N6O12/c24-2-7-13(31)15(33)10(28)21(36-7)40-19-9-4-29-11-16(34)14(32)8(3-25)37-22(11)39-18-6(27)1-5(26)12(30)20(18)41-23(38-9)17(19)35/h5-23,29-35H,1-4,24-28H2/t5-,6+,7+,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1 | | 別名: | CYCLIC NEOMYCIN | | 定義日: | 2005-06-24 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (2R,3S,4R,4aR,7R,8S,9R,10S,11aR,12S,13R,15S,15aR,16aR)-13,15-diamino-2-(aminomethyl)-3,4,9,12-tetrahydroxyhexadecahydro-2H-7,10-epoxypyrano[2,3-b][1,10,4]benzodioxazacyclododecin-8-yl 2,6-diamino-2,6-dideoxy-beta-L-idopyranoside |
|
 | | CO6 | | 表記: | ISOBUTYRYL-COENZYME A | | 組成式: | C25 H42 N7 O17 P3 S | | SMILES: | O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3OP(=O)(O)O)C(C)C | | InChi: | InChI=1S/C25H42N7O17P3S/c1-13(2)24(37)53-8-7-27-15(33)5-6-28-22(36)19(35)25(3,4)10-46-52(43,44)49-51(41,42)45-9-14-18(48-50(38,39)40)17(34)23(47-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,17-,18-,19+,23-/m1/s1 | | 別名: | IB-CO6 | | 定義日: | 2006-10-11 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | S-{(9R,13S,15R)-17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} 2-methylpropanethioate (non-preferred name) |
|
 | | COU | | 表記: | COUMARIN | | 組成式: | C9 H6 O2 | | SMILES: | O=C2Oc1ccccc1C=C2 | | InChi: | InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H | | 別名: | 2H-1-BENZOPYRAN-2-ONE | | 定義日: | 2005-03-09 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 2H-chromen-2-one |
|
 | | CQL | | 表記: | 5-chloro-7-iodoquinolin-8-ol | | 組成式: | C9 H5 Cl I N O | | SMILES: | Ic1c(O)c2ncccc2c(Cl)c1 | | InChi: | InChI=1S/C9H5ClINO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H | | 別名: | Clioquinol | | 定義日: | 2009-10-28 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 5-chloro-7-iodoquinolin-8-ol |
|
 | | 21N | | 表記: | N-{[(2E)-2-{[4-(trifluoromethyl)phenyl]methylidene}hydrazino]carbonothioyl}-beta-D-glucopyranosylamine | | 組成式: | C15 H18 F3 N3 O5 S | | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(cc2)C(F)(F)F | | InChi: | InChI=1S/C15H18F3N3O5S/c16-15(17,18)8-3-1-7(2-4-8)5-19-21-14(27)20-13-12(25)11(24)10(23)9(6-22)26-13/h1-5,9-13,22-25H,6H2,(H2,20,21,27)/b19-5+/t9-,10-,11+,12-,13-/m1/s1 | | 別名: | 4-trifluoromethylbenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone | | 定義日: | 2010-05-03 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | N-({(2E)-2-[4-(trifluoromethyl)benzylidene]hydrazinyl}carbothioyl)-beta-D-glucopyranosylamine |
|
 | | 223 | | 表記: | (3R,4R)-1-[(4-AMINO-5H-PYRROLO[3,2-D]PYRIMIDIN-7-YL)METHYL]-4-(HYDROXYMETHYL)PYRROLIDIN-3-OL | | 組成式: | C12 H17 N5 O2 | | SMILES: | OCC3CN(Cc2cnc1c2ncnc1N)CC3O | | InChi: | InChI=1S/C12H17N5O2/c13-12-11-10(15-6-16-12)7(1-14-11)2-17-3-8(5-18)9(19)4-17/h1,6,8-9,14,18-19H,2-5H2,(H2,13,15,16)/t8-,9+/m1/s1 | | 別名: | 4'-DEAZA-1'-AZA-2'-DEOXY-1'-(9-METHYLENE)-IMMUCILLIN-A | | 定義日: | 2006-10-24 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (3R,4R)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(hydroxymethyl)pyrrolidin-3-ol |
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 | | 22F | | 表記: | (4-fluorophenyl)(pyridin-4-yl)methanone | | 組成式: | C12 H8 F N O | | SMILES: | O=C(c1ccc(F)cc1)c2ccncc2 | | InChi: | InChI=1S/C12H8FNO/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10/h1-8H | | 別名: | 4-(4-fluorobenzoyl)pyridine | | 定義日: | 2009-01-20 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (4-fluorophenyl)(pyridin-4-yl)methanone |
|
 | | 22N | | 表記: | (3R,4S,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid | | 組成式: | C14 H24 N2 O4 | | SMILES: | O=C(O)C1=CC(OC(CC)CC)C(NC(=O)C)C(N)C1 | | InChi: | InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13-/m0/s1 | | 別名: | stereomutated oseltamivir carboxylate | | 定義日: | 2013-08-23 | | 最終更新日: | 2021-03-01 | | 公開日: | 2014-02-12 | | 識別子（ID）: | (3R,4S,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid |
|
 | | 23W | | 表記: | methyl 2-(hydroxymethyl)prop-2-enoate | | 組成式: | C5 H8 O3 | | SMILES: | O=C(OC)/C(=C)CO | | InChi: | InChI=1S/C5H8O3/c1-4(3-6)5(7)8-2/h6H,1,3H2,2H3 | | 別名: | methyl 2-(hydroxymethyl)acrylate | | 定義日: | 2013-08-26 | | 最終更新日: | 2021-03-01 | | 公開日: | 2014-06-25 | | 識別子（ID）: | methyl 2-(hydroxymethyl)prop-2-enoate |
|
 | | 256 | | 表記: | PHENYL(SULFO)ACETIC ACID | | 組成式: | C8 H8 O5 S | | SMILES: | O=S(=O)(O)C(C(=O)O)c1ccccc1 | | InChi: | InChI=1S/C8H8O5S/c9-8(10)7(14(11,12)13)6-4-2-1-3-5-6/h1-5,7H,(H,9,10)(H,11,12,13)/t7-/m1/s1 | | 別名: | RU79256 | | 定義日: | 2003-06-20 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (2R)-phenyl(sulfo)ethanoic acid |
|
 | | 25L | | 表記: | [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate | | 組成式: | C30 H40 N15 O25 P5 | | SMILES: | Nc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(=O)O[CH]4[CH](O)[CH](CO[P](O)(=O)O[CH]5[CH](O)[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)O[CH]5n6cnc7c(N)ncnc67)O[CH]4n8cnc9c(N)ncnc89)[CH](O)[CH]3O | | InChi: | InChI=1S/C30H40N15O25P5/c31-22-13-25(37-4-34-22)43(7-40-13)28-19(49)16(46)10(64-28)1-61-72(53,54)67-20-17(47)11(65-29(20)44-8-41-14-23(32)35-5-38-26(14)44)2-62-73(55,56)68-21-18(48)12(3-63-74(57,58)70-75(59,60)69-71(50,51)52)66-30(21)45-9-42-15-24(33)36-6-39-27(15)45/h4-12,16-21,28-30,46-49H,1-3H2,(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H2,31,34,37)(H2,32,35,38)(H2,33,36,39)(H2,50,51,52)/t10-,11-,12-,16-,17-,18-,19-,20-,21-,28-,29-,30-/m1/s1 | | 別名: | 2'-5'-oligoadenylate trimer | | 定義日: | 2009-09-15 | | 最終更新日: | 2021-03-01 | | 公開日: | 2014-02-05 | | 識別子（ID）: | [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
|
 | | 274 | | 表記: | (3Z)-N-(3-CHLOROPHENYL)-3-({3,5-DIMETHYL-4-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-1H-PYRROL-2-YL}METHYLENE)-N-METHYL-2-OXOINDOLINE-5-SULFONAMIDE | | 組成式: | C28 H30 Cl N5 O4 S | | SMILES: | O=C(N1CCN(C)CC1)c5c(c(/C=C3/c2cc(ccc2NC3=O)S(=O)(=O)N(c4cccc(Cl)c4)C)nc5C)C | | InChi: | InChI=1S/C28H30ClN5O4S/c1-17-25(30-18(2)26(17)28(36)34-12-10-32(3)11-13-34)16-23-22-15-21(8-9-24(22)31-27(23)35)39(37,38)33(4)20-7-5-6-19(29)14-20/h5-9,14-16,30H,10-13H2,1-4H3,(H,31,35)/b23-16- | | 別名: | MET KINASE INHIBITOR | | 定義日: | 2006-10-17 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | (3Z)-N-(3-chlorophenyl)-3-({3,5-dimethyl-4-[(4-methylpiperazin-1-yl)carbonyl]-1H-pyrrol-2-yl}methylidene)-N-methyl-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide |
|
 | | 27R | | 表記: | [2-amino-3-(4-bromobenzoyl)phenyl]acetic acid | | 組成式: | C15 H12 Br N O3 | | SMILES: | O=C(c1ccc(Br)cc1)c2cccc(c2N)CC(=O)O | | InChi: | InChI=1S/C15H12BrNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19) | | 別名: | Bromfenac | | 定義日: | 2013-09-05 | | 最終更新日: | 2021-03-01 | | 公開日: | 2013-09-18 | | 識別子（ID）: | [2-amino-3-(4-bromobenzoyl)phenyl]acetic acid |
|
 | | 29P | | 表記: | 3-[(5S)-5-{[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-1H-pyrrol-2-yl]methyl}-4-(carboxymethyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]propanoic acid | | 組成式: | C20 H24 N2 O9 | | SMILES: | O=C(O)CCc1c(nc(c1CC(=O)O)C)CC2C(=C(C(=O)N2)CCC(=O)O)CC(=O)O | | InChi: | InChI=1S/C20H24N2O9/c1-9-12(6-18(27)28)10(2-4-16(23)24)14(21-9)8-15-13(7-19(29)30)11(20(31)22-15)3-5-17(25)26/h15,21H,2-8H2,1H3,(H,22,31)(H,23,24)(H,25,26)(H,27,28)(H,29,30)/t15-/m0/s1 | | 別名: | Dipyrromethanone | | 定義日: | 2013-09-12 | | 最終更新日: | 2021-03-01 | | 公開日: | 2014-04-02 | | 識別子（ID）: | 3-[(5S)-5-{[3-(2-carboxyethyl)-4-(carboxymethyl)-5-methyl-1H-pyrrol-2-yl]methyl}-4-(carboxymethyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]propanoic acid |
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 | | 2AQ | | 表記: | QUINOLIN-2-AMINE | | 組成式: | C9 H8 N2 | | SMILES: | n1c(ccc2ccccc12)N | | InChi: | InChI=1S/C9H8N2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H2,10,11) | | 別名: | 2-AMINOQUINOLINE | | 定義日: | 2007-01-12 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | quinolin-2-amine |
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 | | 2AR | | 表記: | 2'-DEOXYARISTEROMYCIN-5'-PHOSPHATE | | 組成式: | C11 H16 N5 O5 P | | SMILES: | O=P(O)(O)OCC3CC(n1c2ncnc(c2nc1)N)CC3O | | InChi: | InChI=1S/C11H16N5O5P/c12-10-9-11(14-4-13-10)16(5-15-9)7-1-6(8(17)2-7)3-21-22(18,19)20/h4-8,17H,1-3H2,(H2,12,13,14)(H2,18,19,20)/t6-,7-,8+/m1/s1 | | 別名: | [ADENIN-9-YL-3-HYDROXY-CYCLOPENTAN-5-YL]-METHYL-5'-PHOSPHATE | | 定義日: | 2000-05-04 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | [(1R,2S,4R)-4-(6-amino-9H-purin-9-yl)-2-hydroxycyclopentyl]methyl dihydrogen phosphate |
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 | | 2BP | | 表記: | 9H-purin-2-amine | | 組成式: | C5 H5 N5 | | SMILES: | n1cc2ncnc2nc1N | | InChi: | InChI=1S/C5H5N5/c6-5-7-1-3-4(10-5)9-2-8-3/h1-2H,(H3,6,7,8,9,10) | | 別名: | 2-AMINOPURINE | | 定義日: | 2009-02-05 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 9H-purin-2-amine |
|
 | | 2BT | | 表記: | 2'-O-BUTYL-THYMIDINE | | 組成式: | C14 H23 N2 O9 P | | SMILES: | O=C1NC(=O)N(C=C1C)C2OC(C(O)C2OCCCC)COP(=O)(O)O | | InChi: | InChI=1S/C14H23N2O9P/c1-3-4-5-23-11-10(17)9(7-24-26(20,21)22)25-13(11)16-6-8(2)12(18)15-14(16)19/h6,9-11,13,17H,3-5,7H2,1-2H3,(H,15,18,19)(H2,20,21,22)/t9-,10-,11-,13-/m1/s1 | | 別名: | 2'-O-BUTYL-5-METHYLURIDINE | | 定義日: | 2004-12-16 | | 最終更新日: | 2021-03-01 | | 識別子（ID）: | 2'-O-butyl-5-methyluridine 5'-(dihydrogen phosphate) |
|
 | | 2BV | | 表記: | (R)-(cyclohexylmethyl)[(2S)-3-{[(1S)-1-(3,4-dichlorophenyl)ethyl]amino}-2-hydroxypropyl]phosphinic acid | | 組成式: | C18 H28 Cl2 N O3 P | | SMILES: | Clc1ccc(cc1Cl)C(NCC(O)CP(=O)(O)CC2CCCCC2)C | | InChi: | InChI=1S/C18H28Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24)/t13-,16-/m0/s1 | | 別名: | CGP 54626 | | 定義日: | 2013-09-19 | | 最終更新日: | 2021-03-01 | | 公開日: | 2013-12-11 | | 識別子（ID）: | (R)-(cyclohexylmethyl)[(2S)-3-{[(1S)-1-(3,4-dichlorophenyl)ethyl]amino}-2-hydroxypropyl]phosphinic acid |
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 | | 2BX | | 表記: | [(2S)-5,5-dimethylmorpholin-2-yl]acetic acid | | 組成式: | C8 H15 N O3 | | SMILES: | O=C(O)CC1OCC(NC1)(C)C | | InChi: | InChI=1S/C8H15NO3/c1-8(2)5-12-6(4-9-8)3-7(10)11/h6,9H,3-5H2,1-2H3,(H,10,11)/t6-/m0/s1 | | 別名: | SCH50911 | | 定義日: | 2013-09-19 | | 最終更新日: | 2021-03-01 | | 公開日: | 2013-12-11 | | 識別子（ID）: | [(2S)-5,5-dimethylmorpholin-2-yl]acetic acid |
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 | | 2CR | | 表記: | (1R,2R)-2-[(2S,4E,6E,8R,9S,11R,13S,15S,16S)-7-cyano-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxooxacyclooctadeca-4,6-dien-2-yl]cyclopentanecarboxylic acid | | 組成式: | C28 H43 N O6 | | SMILES: | O=C(O)C1CCCC1C2OC(=O)CC(O)C(C)CC(C)CC(C)CC(C(O)C(C#N)=CC=CC2)C | | InChi: | InChI=1S/C28H43NO6/c1-17-12-18(2)14-20(4)27(32)21(16-29)8-5-6-11-25(22-9-7-10-23(22)28(33)34)35-26(31)15-24(30)19(3)13-17/h5-6,8,17-20,22-25,27,30,32H,7,9-15H2,1-4H3,(H,33,34)/b6-5+,21-8+/t17-,18+,19-,20-,22+,23+,24-,25-,27+/m0/s1 | | 別名: | Borrelidin | | 定義日: | 2014-03-19 | | 最終更新日: | 2021-03-01 | | 公開日: | 2015-03-11 | | 識別子（ID）: | (1R,2R)-2-[(2S,4E,6E,8R,9S,11R,13S,15S,16S)-7-cyano-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxooxacyclooctadeca-4,6-dien-2-yl]cyclopentanecarboxylic acid |
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