![SIS SIS](https://data.pdbj.org/pdbjplus/data/cc/svg/SIS.svg) | SIS | 表記: | (1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-hydroxycyclohexyl 3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranoside | 組成式: | C19 H37 N5 O7 | SMILES: | O(C2C(O)C(OC1OC(=CCC1N)CN)C(N)CC2N)C3OCC(O)(C(NC)C3O)C | InChi: | InChI=1S/C19H37N5O7/c1-19(27)7-28-18(13(26)16(19)24-2)31-15-11(23)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17/h3,9-18,24-27H,4-7,20-23H2,1-2H3/t9-,10+,11-,12+,13-,14-,15+,16-,17-,18-,19+/m1/s1 | 別名: | Sisomicin | 定義日: | 2012-06-12 | 最終更新日: | 2021-03-01 | 識別子(ID): | (1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-hydroxycyclohexyl 3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranoside |
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![0CZ 0CZ](https://data.pdbj.org/pdbjplus/data/cc/svg/0CZ.svg) | 0CZ | 表記: | 4,4'-(1,1,1,3,3,3-hexafluoropropane-2,2-diyl)diphenol | 組成式: | C15 H10 F6 O2 | SMILES: | FC(F)(F)C(c1ccc(O)cc1)(c2ccc(O)cc2)C(F)(F)F | InChi: | InChI=1S/C15H10F6O2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8,22-23H | 別名: | BISPHENOL AF | 定義日: | 2011-12-13 | 最終更新日: | 2021-03-01 | 識別子(ID): | 4,4'-(1,1,1,3,3,3-hexafluoropropane-2,2-diyl)diphenol |
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![0DB 0DB](https://data.pdbj.org/pdbjplus/data/cc/svg/0DB.svg) | 0DB | 表記: | N-({1-[(2S)-2-carboxy-4-phenylbutyl]cyclopentyl}carbonyl)-L-tryptophan | 組成式: | C28 H32 N2 O5 | SMILES: | O=C(O)C(CCc1ccccc1)CC4(C(=O)NC(C(=O)O)Cc3c2ccccc2nc3)CCCC4 | InChi: | InChI=1S/C28H32N2O5/c31-25(32)20(13-12-19-8-2-1-3-9-19)17-28(14-6-7-15-28)27(35)30-24(26(33)34)16-21-18-29-23-11-5-4-10-22(21)23/h1-5,8-11,18,20,24,29H,6-7,12-17H2,(H,30,35)(H,31,32)(H,33,34)/t20-,24+/m1/s1 | 別名: | CCT | 定義日: | 2008-11-12 | 最終更新日: | 2021-03-01 | 識別子(ID): | N-({1-[(2S)-2-carboxy-4-phenylbutyl]cyclopentyl}carbonyl)-L-tryptophan |
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![0DS 0DS](https://data.pdbj.org/pdbjplus/data/cc/svg/0DS.svg) | 0DS | 表記: | N-{(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-L-leucyl-L-phenylalaninamide | 組成式: | C23 H36 N4 O5 | SMILES: | O=C(NO)CC(C(=O)NC(C(=O)NC(C(=O)N)Cc1ccccc1)CC(C)C)CC(C)C | InChi: | InChI=1S/C23H36N4O5/c1-14(2)10-17(13-20(28)27-32)22(30)26-19(11-15(3)4)23(31)25-18(21(24)29)12-16-8-6-5-7-9-16/h5-9,14-15,17-19,32H,10-13H2,1-4H3,(H2,24,29)(H,25,31)(H,26,30)(H,27,28)/t17-,18+,19+/m1/s1 | 別名: | ICI U24522 | 定義日: | 2008-11-10 | 最終更新日: | 2021-03-01 | 識別子(ID): | N-{(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-L-leucyl-L-phenylalaninamide |
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![SKA SKA](https://data.pdbj.org/pdbjplus/data/cc/svg/SKA.svg) | SKA | 表記: | 7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE | 組成式: | C9 H9 Cl2 N | SMILES: | Clc1c(Cl)ccc2c1CNCC2 | InChi: | InChI=1S/C9H9Cl2N/c10-8-2-1-6-3-4-12-5-7(6)9(8)11/h1-2,12H,3-5H2 | 別名: | SK&F 64139 | 定義日: | 2005-03-02 | 最終更新日: | 2021-03-01 | 識別子(ID): | 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline |
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![0E9 0E9](https://data.pdbj.org/pdbjplus/data/cc/svg/0E9.svg) | 0E9 | 表記: | benzyl [(1R,4S,6S,9R)-4,6-dibenzyl-5-hydroxy-1,9-bis(1-methylethyl)-2,8,11-trioxo-13-phenyl-12-oxa-3,7,10-triazatridec-1-yl]carbamate | 組成式: | C43 H52 N4 O7 | SMILES: | O=C(OCc1ccccc1)NC(C(=O)NC(Cc2ccccc2)C(O)C(NC(=O)C(NC(=O)OCc3ccccc3)C(C)C)Cc4ccccc4)C(C)C | InChi: | InChI=1S/C43H52N4O7/c1-29(2)37(46-42(51)53-27-33-21-13-7-14-22-33)40(49)44-35(25-31-17-9-5-10-18-31)39(48)36(26-32-19-11-6-12-20-32)45-41(50)38(30(3)4)47-43(52)54-28-34-23-15-8-16-24-34/h5-24,29-30,35-39,48H,25-28H2,1-4H3,(H,44,49)(H,45,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1 | 別名: | A-74704 | 定義日: | 2008-11-07 | 最終更新日: | 2021-03-01 | 識別子(ID): | benzyl [(1R,4S,6S,9R)-4,6-dibenzyl-5-hydroxy-1,9-bis(1-methylethyl)-2,8,11-trioxo-13-phenyl-12-oxa-3,7,10-triazatridec-1-yl]carbamate (non-preferred name) |
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![SKK SKK](https://data.pdbj.org/pdbjplus/data/cc/svg/SKK.svg) | SKK | 表記: | N-[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl}amino)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide | 組成式: | C19 H25 N7 O2 | SMILES: | N#CC3N(C(=O)CNC(C)(C)CNC(=O)c1cn2nc(cc2nc1)C)CCC3 | InChi: | InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1 | 別名: | Anagliptin | 定義日: | 2014-02-07 | 最終更新日: | 2021-03-01 | 公開日: | 2015-07-15 | 識別子(ID): | N-[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl}amino)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide |
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![SKM SKM](https://data.pdbj.org/pdbjplus/data/cc/svg/SKM.svg) | SKM | 表記: | (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID | 組成式: | C7 H10 O5 | SMILES: | O=C(O)C1=CC(O)C(O)C(O)C1 | InChi: | InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1 | 別名: | SHIKIMATE | 定義日: | 2004-08-16 | 最終更新日: | 2021-03-01 | 識別子(ID): | (3R,4S,5R)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid |
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![SKP SKP](https://data.pdbj.org/pdbjplus/data/cc/svg/SKP.svg) | SKP | 表記: | 5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-1-ENECARBOXYLIC ACID | 組成式: | C10 H16 O14 P2 | SMILES: | O=C(O)C(OP(=O)(O)O)(OC1CC(=CC(OP(=O)(O)O)C1O)C(=O)O)C | InChi: | InChI=1S/C10H16O14P2/c1-10(9(14)15,24-26(19,20)21)22-5-2-4(8(12)13)3-6(7(5)11)23-25(16,17)18/h3,5-7,11H,2H2,1H3,(H,12,13)(H,14,15)(H2,16,17,18)(H2,19,20,21)/t5-,6-,7+,10+/m1/s1 | 別名: | 5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-SHIKIMATE-3-PHOSPHATE | 定義日: | 2003-08-13 | 最終更新日: | 2021-03-01 | 識別子(ID): | (3R,4S,5R)-5-[(1S)-1-carboxy-1-(phosphonooxy)ethoxy]-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid |
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![0ET 0ET](https://data.pdbj.org/pdbjplus/data/cc/svg/0ET.svg) | 0ET | 表記: | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[[3-oxidanylidene-3-[2-[(2R)-2-oxidanylundecyl]sulfanylethylamino]propyl]amino]butyl] hydrogen phosphate | 組成式: | C32 H58 N7 O17 P3 S | SMILES: | O=C(NCCSCC(O)CCCCCCCCC)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3OP(=O)(O)O | InChi: | InChI=1S/C32H58N7O17P3S/c1-4-5-6-7-8-9-10-11-21(40)17-60-15-14-34-23(41)12-13-35-30(44)27(43)32(2,3)18-53-59(50,51)56-58(48,49)52-16-22-26(55-57(45,46)47)25(42)31(54-22)39-20-38-24-28(33)36-19-37-29(24)39/h19-22,25-27,31,40,42-43H,4-18H2,1-3H3,(H,34,41)(H,35,44)(H,48,49)(H,50,51)(H2,33,36,37)(H2,45,46,47)/t21-,22-,25-,26-,27+,31-/m1/s1 | 別名: | undecan-2-one-CoA | 定義日: | 2012-08-08 | 最終更新日: | 2021-03-01 | 公開日: | 2012-08-24 | 識別子(ID): | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-[(2-{[(2R)-2-hydroxyundecyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate (non-preferred name) |
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![SL0 SL0](https://data.pdbj.org/pdbjplus/data/cc/svg/SL0.svg) | SL0 | 表記: | 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 3,4-di-O-acetyl-6-deoxy-alpha-L-mannopyranoside | 組成式: | C25 H24 O12 | SMILES: | O=C2C(OC1OC(C(OC(=O)C)C(OC(=O)C)C1O)C)=C(Oc3cc(O)cc(O)c23)c4ccc(O)cc4 | InChi: | InChI=1S/C25H24O12/c1-10-21(34-11(2)26)24(35-12(3)27)20(32)25(33-10)37-23-19(31)18-16(30)8-15(29)9-17(18)36-22(23)13-4-6-14(28)7-5-13/h4-10,20-21,24-25,28-30,32H,1-3H3/t10-,20+,21-,24-,25-/m0/s1 | 別名: | SL 0101-1 | 定義日: | 2011-11-16 | 最終更新日: | 2021-03-01 | 公開日: | 2012-08-31 | 識別子(ID): | 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 3,4-di-O-acetyl-6-deoxy-alpha-L-mannopyranoside |
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![SLC SLC](https://data.pdbj.org/pdbjplus/data/cc/svg/SLC.svg) | SLC | 表記: | SELENO-CAPTOPRIL | 組成式: | C9 H13 N O3 Se | SMILES: | O=C(O)C1N(C(=O)C(=C)C[SeH])CCC1 | InChi: | InChI=1S/C9H13NO3Se/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h7,14H,1-5H2,(H,12,13)/t7-/m0/s1 | 別名: | 1-[2-(SELANYLMETHYL)ACRYLOYL]-L-PROLINE | 定義日: | 2011-03-22 | 最終更新日: | 2021-03-01 | 識別子(ID): | 1-[2-(selanylmethyl)acryloyl]-L-proline |
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![2F0 2F0](https://data.pdbj.org/pdbjplus/data/cc/svg/2F0.svg) | 2F0 | 表記: | 2-chloro-5-{[(2-{3-[(1E)-N-hydroxyethanimidoyl]phenyl}propan-2-yl)carbamoyl]amino}benzamide | 組成式: | C19 H21 Cl N4 O3 | SMILES: | O=C(c1cc(ccc1Cl)NC(=O)NC(c2cccc(C(=NO)C)c2)(C)C)N | InChi: | InChI=1S/C19H21ClN4O3/c1-11(24-27)12-5-4-6-13(9-12)19(2,3)23-18(26)22-14-7-8-16(20)15(10-14)17(21)25/h4-10,27H,1-3H3,(H2,21,25)(H2,22,23,26)/b24-11+ | 別名: | P32 | 定義日: | 2013-10-03 | 最終更新日: | 2021-03-01 | 公開日: | 2014-07-23 | 識別子(ID): | 2-chloro-5-{[(2-{3-[(1E)-N-hydroxyethanimidoyl]phenyl}propan-2-yl)carbamoyl]amino}benzamide |
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![SLN SLN](https://data.pdbj.org/pdbjplus/data/cc/svg/SLN.svg) | SLN | 表記: | 1-(4-AZIDO-2-NITROPHENYL)AMINO-3-(1-OXYL-2,2,5,5-TETRAMETHYLPYRROLIDINYL-3-CARBAMIDO)-2-PROPYLDISPHOSPHATE | 組成式: | C18 H29 N7 O11 P2 | SMILES: | [O-][N+](=O)c1cc(/N=[N+]=[N-])ccc1NCC(OP(=O)(O)OP(=O)(O)O)CNC(=O)C2C(N(O)C(C)(C)C2)(C)C | InChi: | InChI=1S/C18H29N7O11P2/c1-17(2)8-13(18(3,4)25(17)29)16(26)21-10-12(35-38(33,34)36-37(30,31)32)9-20-14-6-5-11(22-23-19)7-15(14)24(27)28/h5-7,12-13,20,29H,8-10H2,1-4H3,(H,21,26)(H,33,34)(H2,30,31,32)/t12-,13-/m0/s1 | 別名: | (SL-NANDP) | 定義日: | 2003-04-22 | 最終更新日: | 2021-03-01 | 識別子(ID): | (1S)-2-[(4-azido-2-nitrophenyl)amino]-1-[({[(3R)-1-hydroxy-2,2,5,5-tetramethylpyrrolidin-3-yl]carbonyl}amino)methyl]ethyl trihydrogen diphosphate |
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![SLO SLO](https://data.pdbj.org/pdbjplus/data/cc/svg/SLO.svg) | SLO | 表記: | 2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]ethanoic acid | 組成式: | C20 H17 F O4 S | SMILES: | O=S(=O)(c1ccc(cc1)/C=C3c2ccc(F)cc2C(=C3C)CC(=O)O)C | InChi: | InChI=1S/C20H17FO4S/c1-12-17(9-13-3-6-15(7-4-13)26(2,24)25)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9- | 別名: | sulindac sulfone | 定義日: | 2011-05-19 | 最終更新日: | 2021-03-01 | 識別子(ID): | {(1Z)-5-fluoro-2-methyl-1-[4-(methylsulfonyl)benzylidene]-1H-inden-3-yl}acetic acid |
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![2G7 2G7](https://data.pdbj.org/pdbjplus/data/cc/svg/2G7.svg) | 2G7 | 表記: | P-((((benzyloxy)carbonyl)amino)methyl)-N-((S)-1-(isobutylamino)-4-methyl-1-oxopentan-2-yl)phosphonamidic acid | 組成式: | C19 H32 N3 O5 P | SMILES: | O=C(NCC(C)C)C(NP(=O)(O)CNC(=O)OCc1ccccc1)CC(C)C | InChi: | InChI=1S/C19H32N3O5P/c1-14(2)10-17(18(23)20-11-15(3)4)22-28(25,26)13-21-19(24)27-12-16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3,(H,20,23)(H,21,24)(H2,22,25,26)/t17-/m0/s1 | 別名: | N~2~-[(R)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2-methylpropyl)-L-leucinamide | 定義日: | 2013-10-11 | 最終更新日: | 2021-03-01 | 公開日: | 2014-04-02 | 識別子(ID): | N~2~-[(R)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2-methylpropyl)-L-leucinamide |
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![2GC 2GC](https://data.pdbj.org/pdbjplus/data/cc/svg/2GC.svg) | 2GC | 表記: | P-((((benzyloxy)carbonyl)amino)methyl)-N-((S)-4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl)phosphonamidic acid | 組成式: | C23 H32 N3 O5 P | SMILES: | C(OC(=O)NCP(NC(CC(C)C)C(=O)NCCc1ccccc1)(=O)O)c2ccccc2 | InChi: | InChI=1S/C23H32N3O5P/c1-18(2)15-21(22(27)24-14-13-19-9-5-3-6-10-19)26-32(29,30)17-25-23(28)31-16-20-11-7-4-8-12-20/h3-12,18,21H,13-17H2,1-2H3,(H,24,27)(H,25,28)(H2,26,29,30)/t21-/m0/s1 | 別名: | N~2~-[(R)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2-phenylethyl)-L-leucinamide | 定義日: | 2013-10-11 | 最終更新日: | 2021-03-01 | 公開日: | 2014-04-02 | 識別子(ID): | N~2~-[(R)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2-phenylethyl)-L-leucinamide |
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![2GF 2GF](https://data.pdbj.org/pdbjplus/data/cc/svg/2GF.svg) | 2GF | 表記: | [(2R,5R)-5-(4-amino-5-chloro-2-oxopyrimidin-1(2H)-yl)-3-oxotetrahydrofuran-2-yl]methyl dihydrogen phosphate | 組成式: | C9 H11 Cl N3 O7 P | SMILES: | O=P(O)(O)OCC2OC(N1C(=O)N=C(N)C(Cl)=C1)CC2=O | InChi: | InChI=1S/C9H11ClN3O7P/c10-4-2-13(9(15)12-8(4)11)7-1-5(14)6(20-7)3-19-21(16,17)18/h2,6-7H,1,3H2,(H2,11,12,15)(H2,16,17,18)/t6-,7-/m1/s1 | 別名: | 5-CHLORO DEOXYCYTIDINE-5'-MONOPHOSPHATE | 定義日: | 2013-10-15 | 最終更新日: | 2021-03-01 | 公開日: | 2013-11-06 | 識別子(ID): | [(2R,5R)-5-(4-amino-5-chloro-2-oxopyrimidin-1(2H)-yl)-3-oxotetrahydrofuran-2-yl]methyl dihydrogen phosphate |
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![SMZ SMZ](https://data.pdbj.org/pdbjplus/data/cc/svg/SMZ.svg) | SMZ | 表記: | N~5~-[(E)-imino(methylsulfanyl)methyl]-L-ornithine | 組成式: | C7 H15 N3 O2 S | SMILES: | O=C(O)C(N)CCCNC(=[N@H])SC | InChi: | InChI=1S/C7H15N3O2S/c1-13-7(9)10-4-2-3-5(8)6(11)12/h5H,2-4,8H2,1H3,(H2,9,10)(H,11,12)/t5-/m0/s1 | 別名: | S-methyl-L-thiocitrulline | 定義日: | 2008-01-15 | 最終更新日: | 2021-03-01 | 識別子(ID): | N~5~-[(Z)-imino(methylsulfanyl)methyl]-L-ornithine |
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![SN6 SN6](https://data.pdbj.org/pdbjplus/data/cc/svg/SN6.svg) | SN6 | 表記: | 1-METHYL-4-[4-[4-(4-(1-METHYLQUINOLINIUM)AMINO)BENZAMIDO]ANILINO]PYRIDINIUM | 組成式: | C29 H27 N5 O | SMILES: | O=C(Nc2ccc(Nc1cc[n+](cc1)C)cc2)c3ccc(cc3)Nc5c4c(cccc4)[n+](cc5)C | InChi: | InChI=1S/C29H25N5O/c1-33-18-15-25(16-19-33)30-22-11-13-24(14-12-22)32-29(35)21-7-9-23(10-8-21)31-27-17-20-34(2)28-6-4-3-5-26(27)28/h3-20H,1-2H3,(H,32,35)/p+2 | 別名: | SN6999 | 定義日: | 1999-07-08 | 最終更新日: | 2021-03-01 | 識別子(ID): | 1-methyl-4-{[4-({4-[(1-methylpyridinium-4-yl)amino]phenyl}carbamoyl)phenyl]amino}quinolinium |
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![SN7 SN7](https://data.pdbj.org/pdbjplus/data/cc/svg/SN7.svg) | SN7 | 表記: | 4-[4-[2-AMINO-4-[4,6-(N-METHYLQUINOLINIUM)AMINO]BENZAMIDO]ANILINO]-N-METHYLPYRIDINIUM MESYLATE | 組成式: | C29 H29 N7 O | SMILES: | O=C(Nc2ccc(Nc1cc[n+](cc1)C)cc2)c3ccc(cc3N)Nc5c4c(ccc(c4)N)[n+](cc5)C | InChi: | InChI=1S/C29H27N7O/c1-35-14-11-22(12-15-35)32-20-4-6-21(7-5-20)34-29(37)24-9-8-23(18-26(24)31)33-27-13-16-36(2)28-10-3-19(30)17-25(27)28/h3-18H,30H2,1-2H3,(H3,31,34,37)/p+2 | 別名: | SN7167 | 定義日: | 1999-07-08 | 最終更新日: | 2021-03-01 | 識別子(ID): | 6-amino-4-{[3-amino-4-({4-[(1-methylpyridinium-4-yl)amino]phenyl}carbamoyl)phenyl]amino}-1-methylquinolinium |
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![SN8 SN8](https://data.pdbj.org/pdbjplus/data/cc/svg/SN8.svg) | SN8 | 表記: | 1,6-DIMETHYL-4-(4-(4-(1-METHYLPYRIDINIUM-4-YLAMINO)PHENYLCARBAMOYL)PHENYLAMINO)QUINOLINIUM | 組成式: | C30 H47 N5 O | SMILES: | O=C(NC2CCC(NC1CCN(C)CC1)CC2)C5CCC(NC=4c3cc(ccc3N(C)CC=4)C)CC5 | InChi: | InChI=1S/C30H47N5O/c1-21-4-13-29-27(20-21)28(16-19-35(29)3)32-24-7-5-22(6-8-24)30(36)33-25-11-9-23(10-12-25)31-26-14-17-34(2)18-15-26/h4,13,16,20,22-26,31-32H,5-12,14-15,17-19H2,1-3H3,(H,33,36)/t22?,23-,24?,25+ | 別名: | SN8315 | 定義日: | 2005-05-20 | 最終更新日: | 2021-03-01 | 識別子(ID): | trans-4-[(1,6-dimethyl-1,2-dihydroquinolin-4-yl)amino]-N-{cis-4-[(1-methylpiperidin-4-yl)amino]cyclohexyl}cyclohexanecarboxamide |
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![2H0 2H0](https://data.pdbj.org/pdbjplus/data/cc/svg/2H0.svg) | 2H0 | 表記: | P-((((benzyloxy)carbonyl)amino)methyl)-N-((S)-1-(isopentylamino)-4-methyl-1-oxopentan-2-yl)phosphonamidic acid | 組成式: | C20 H34 N3 O5 P | SMILES: | O=C(NCCC(C)C)C(NP(=O)(O)CNC(=O)OCc1ccccc1)CC(C)C | InChi: | InChI=1S/C20H34N3O5P/c1-15(2)10-11-21-19(24)18(12-16(3)4)23-29(26,27)14-22-20(25)28-13-17-8-6-5-7-9-17/h5-9,15-16,18H,10-14H2,1-4H3,(H,21,24)(H,22,25)(H2,23,26,27)/t18-/m0/s1 | 別名: | N~2~-[(S)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(3-methylbutyl)-L-leucinamide | 定義日: | 2013-10-17 | 最終更新日: | 2021-03-01 | 公開日: | 2014-04-02 | 識別子(ID): | N~2~-[(S)-({[(benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(3-methylbutyl)-L-leucinamide |
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![SNI SNI](https://data.pdbj.org/pdbjplus/data/cc/svg/SNI.svg) | SNI | 表記: | 9-(3,4-DIHYDROXY-5-HYDROXYMETHYL-TETRAHYDRO-FURAN-2-YL)-1,9-DIHYDRO-PURINE-6-THIONE | 組成式: | C10 H12 N4 O4 Se | SMILES: | [Se]=C1c2ncn(c2N=CN1)C3OC(C(O)C3O)CO | InChi: | InChI=1S/C10H12N4O4Se/c15-1-4-6(16)7(17)10(18-4)14-3-13-5-8(14)11-2-12-9(5)19/h2-4,6-7,10,15-17H,1H2,(H,11,12,19)/t4-,6-,7-,10-/m1/s1 | 別名: | SELENOINOSINE | 定義日: | 2004-02-25 | 最終更新日: | 2021-03-01 | 識別子(ID): | 9-beta-D-ribofuranosyl-1,9-dihydro-6H-purine-6-selone |
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![SNO SNO](https://data.pdbj.org/pdbjplus/data/cc/svg/SNO.svg) | SNO | 表記: | (S)-PARA-NITROSTYRENE OXIDE | 組成式: | C8 H7 N O3 | SMILES: | [O-][N+](=O)c1ccc(cc1)C2OC2 | InChi: | InChI=1S/C8H7NO3/c10-9(11)7-3-1-6(2-4-7)8-5-12-8/h1-4,8H,5H2/t8-/m1/s1 | 別名: | (2S)-2-(4-NITROPHENYL)OXIRANE | 定義日: | 2005-05-20 | 最終更新日: | 2021-03-01 | 識別子(ID): | (2S)-2-(4-nitrophenyl)oxirane |
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