![D03 D03](https://data.pdbj.org/pdbjplus/data/cc/svg/D03.svg) | D03 | 表記: | (S)-N-benzyl-3-((S)-2-cinnamamido-3-phenylpropanamido)-2-oxo-4-((S)-2-oxopyrrolidin-3-yl)butanamide | 組成式: | C33 H36 N4 O5 | SMILES: | O[CH]([CH](C[CH]1CCNC1=O)NC(=O)[CH](Cc2ccccc2)NC(=O)C=Cc3ccccc3)C(=O)NCc4ccccc4 | InChi: | InChI=1S/C33H36N4O5/c38-29(17-16-23-10-4-1-5-11-23)36-28(20-24-12-6-2-7-13-24)32(41)37-27(21-26-18-19-34-31(26)40)30(39)33(42)35-22-25-14-8-3-9-15-25/h1-17,26-28,30,39H,18-22H2,(H,34,40)(H,35,42)(H,36,38)(H,37,41)/b17-16+/t26-,27-,28-,30-/m0/s1 | 定義日: | 2017-02-06 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | (2~{S},3~{S})-2-oxidanyl-4-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]-~{N}-(phenylmethyl)-3-[[(2~{S})-3-phenyl-2-[[(~{E})-3-phenylprop-2-enoyl]amino]propanoyl]amino]butanamide |
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![N7N N7N](https://data.pdbj.org/pdbjplus/data/cc/svg/N7N.svg) | N7N | 表記: | (3~{S})-3-[[(3~{S},6~{S},10~{a}~{S})-6-(isoquinolin-1-ylcarbonylamino)-5-oxidanylidene-2,3,6,7,8,9,10,10~{a}-octahydro-1~{H}-pyrrolo[1,2-a]azocin-3-yl]carbonylamino]-4-oxidanyl-butanoic acid | 組成式: | C25 H30 N4 O6 | SMILES: | OC[CH](CC(O)=O)NC(=O)[CH]1CC[CH]2CCCC[CH](NC(=O)c3nccc4ccccc34)C(=O)N12 | InChi: | InChI=1S/C25H30N4O6/c30-14-16(13-21(31)32)27-23(33)20-10-9-17-6-2-4-8-19(25(35)29(17)20)28-24(34)22-18-7-3-1-5-15(18)11-12-26-22/h1,3,5,7,11-12,16-17,19-20,30H,2,4,6,8-10,13-14H2,(H,27,33)(H,28,34)(H,31,32)/t16-,17-,19-,20-/m0/s1 | 定義日: | 2017-01-09 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | (3~{S})-3-[[(3~{S},6~{S},10~{a}~{S})-6-(isoquinolin-1-ylcarbonylamino)-5-oxidanylidene-2,3,6,7,8,9,10,10~{a}-octahydro-1~{H}-pyrrolo[1,2-a]azocin-3-yl]carbonylamino]-4-oxidanyl-butanoic acid |
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![DQV DQV](https://data.pdbj.org/pdbjplus/data/cc/svg/DQV.svg) | DQV | 表記: | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) | 組成式: | C22 H28 N6 O14 P2 | SMILES: | O=P(O)(OP(O)(=O)OCC3OC(n1cnc2c1ncnc2N)C(C3O)O)OCC5C(O)C(C(c4cccc(c4)C(=O)N)O5)O | InChi: | InChI=1S/C22H28N6O14P2/c23-19-13-21(26-7-25-19)28(8-27-13)22-17(32)15(30)12(41-22)6-39-44(36,37)42-43(34,35)38-5-11-14(29)16(31)18(40-11)9-2-1-3-10(4-9)20(24)33/h1-4,7-8,11-12,14-18,22,29-32H,5-6H2,(H2,24,33)(H,34,35)(H,36,37)(H2,23,25,26)/t11-,12-,14-,15-,16-,17-,18+,22-/m1/s1 | 定義日: | 2017-11-01 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name) |
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![DV4 DV4](https://data.pdbj.org/pdbjplus/data/cc/svg/DV4.svg) | DV4 | 表記: | 4-{[4-(acetylamino)-1-methyl-1H-pyrrole-2-carbonyl]amino}-1-methyl-N-{4-[(1-methyl-1H-pyrrol-3-yl)amino]-4-oxobutyl}-1H-imidazole-2-carboxamide | 組成式: | C22 H28 N8 O4 | SMILES: | c2(C(=O)NCCCC(=O)Nc1ccn(C)c1)n(cc(n2)NC(c3cc(cn3C)NC(C)=O)=O)C | InChi: | InChI=1S/C22H28N8O4/c1-14(31)24-16-10-17(29(3)12-16)21(33)27-18-13-30(4)20(26-18)22(34)23-8-5-6-19(32)25-15-7-9-28(2)11-15/h7,9-13H,5-6,8H2,1-4H3,(H,23,34)(H,24,31)(H,25,32)(H,27,33) | 定義日: | 2017-11-08 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 4-{[4-(acetylamino)-1-methyl-1H-pyrrole-2-carbonyl]amino}-1-methyl-N-{4-[(1-methyl-1H-pyrrol-3-yl)amino]-4-oxobutyl}-1H-imidazole-2-carboxamide |
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![DY2 DY2](https://data.pdbj.org/pdbjplus/data/cc/svg/DY2.svg) | DY2 | 表記: | 7-methoxy-3-methyl-2-[5-[4-(trifluoromethyloxy)phenyl]pyridin-3-yl]quinolin-4-ol | 組成式: | C23 H17 F3 N2 O3 | SMILES: | COc1ccc2c(O)c(C)c(nc2c1)c3cncc(c3)c4ccc(OC(F)(F)F)cc4 | InChi: | InChI=1S/C23H17F3N2O3/c1-13-21(28-20-10-18(30-2)7-8-19(20)22(13)29)16-9-15(11-27-12-16)14-3-5-17(6-4-14)31-23(24,25)26/h3-12H,1-2H3,(H,28,29) | 定義日: | 2018-02-05 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 7-methoxy-3-methyl-2-[5-[4-(trifluoromethyloxy)phenyl]pyridin-3-yl]quinolin-4-ol |
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![EVY EVY](https://data.pdbj.org/pdbjplus/data/cc/svg/EVY.svg) | EVY | 表記: | (2S)-2-hexyl-N-[(3S)-2-oxooxolan-3-yl]decanamide | 組成式: | C20 H37 N O3 | SMILES: | CCCCCCCCC(CCCCCC)C(=O)NC1C(OCC1)=O | InChi: | InChI=1S/C20H37NO3/c1-3-5-7-9-10-12-14-17(13-11-8-6-4-2)19(22)21-18-15-16-24-20(18)23/h17-18H,3-16H2,1-2H3,(H,21,22)/t17-,18-/m0/s1 | 定義日: | 2018-02-05 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | (2S)-2-hexyl-N-[(3S)-2-oxooxolan-3-yl]decanamide |
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![EWM EWM](https://data.pdbj.org/pdbjplus/data/cc/svg/EWM.svg) | EWM | 表記: | N-[(3S)-2-oxooxolan-3-yl]dodecanamide | 組成式: | C16 H29 N O3 | SMILES: | O=C(CCCCCCCCCCC)NC1CCOC1=O | InChi: | InChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18)/t14-/m0/s1 | 定義日: | 2018-02-06 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | N-[(3S)-2-oxooxolan-3-yl]dodecanamide |
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![EY7 EY7](https://data.pdbj.org/pdbjplus/data/cc/svg/EY7.svg) | EY7 | 表記: | 3-(3-methoxyquinoxalin-2-yl)propanoic acid | 組成式: | C12 H12 N2 O3 | SMILES: | OC(=O)CCc2c(nc1c(cccc1)n2)OC | InChi: | InChI=1S/C12H12N2O3/c1-17-12-10(6-7-11(15)16)13-8-4-2-3-5-9(8)14-12/h2-5H,6-7H2,1H3,(H,15,16) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3-(3-methoxyquinoxalin-2-yl)propanoic acid |
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![EYA EYA](https://data.pdbj.org/pdbjplus/data/cc/svg/EYA.svg) | EYA | 表記: | 3-(3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)propanoic acid | 組成式: | C12 H12 N2 O3 | SMILES: | C=1(N(C)C(=O)c2c(N=1)cccc2)CCC(O)=O | InChi: | InChI=1S/C12H12N2O3/c1-14-10(6-7-11(15)16)13-9-5-3-2-4-8(9)12(14)17/h2-5H,6-7H2,1H3,(H,15,16) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3-(3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)propanoic acid |
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![EYJ EYJ](https://data.pdbj.org/pdbjplus/data/cc/svg/EYJ.svg) | EYJ | 表記: | 3-(1,3-benzothiazol-2-yl)propanoic acid | 組成式: | C10 H9 N O2 S | SMILES: | C(Cc1sc2c(n1)cccc2)C(O)=O | InChi: | InChI=1S/C10H9NO2S/c12-10(13)6-5-9-11-7-3-1-2-4-8(7)14-9/h1-4H,5-6H2,(H,12,13) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3-(1,3-benzothiazol-2-yl)propanoic acid |
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![EYM EYM](https://data.pdbj.org/pdbjplus/data/cc/svg/EYM.svg) | EYM | 表記: | 3-(4-methyl-3-oxo-3,4-dihydroquinoxalin-2-yl)propanoic acid | 組成式: | C12 H12 N2 O3 | SMILES: | c2ccc1c(N=C(C(=O)N1C)CCC(O)=O)c2 | InChi: | InChI=1S/C12H12N2O3/c1-14-10-5-3-2-4-8(10)13-9(12(14)17)6-7-11(15)16/h2-5H,6-7H2,1H3,(H,15,16) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3-(4-methyl-3-oxo-3,4-dihydroquinoxalin-2-yl)propanoic acid |
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![EYP EYP](https://data.pdbj.org/pdbjplus/data/cc/svg/EYP.svg) | EYP | 表記: | 3,3'-(benzo[1,2-d:5,4-d']bis[1,3]thiazole-2,6-diyl)dipropanoic acid | 組成式: | C14 H12 N2 O4 S2 | SMILES: | OC(CCc3sc2c(cc1c(sc(CCC(O)=O)n1)c2)n3)=O | InChi: | InChI=1S/C14H12N2O4S2/c17-13(18)3-1-11-15-7-5-8-10(6-9(7)21-11)22-12(16-8)2-4-14(19)20/h5-6H,1-4H2,(H,17,18)(H,19,20) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3,3'-(benzo[1,2-d:5,4-d']bis[1,3]thiazole-2,6-diyl)dipropanoic acid |
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![EYY EYY](https://data.pdbj.org/pdbjplus/data/cc/svg/EYY.svg) | EYY | 表記: | 3-(quinolin-2-yl)propanoic acid | 組成式: | C12 H11 N O2 | SMILES: | C(C(O)=O)Cc2ccc1ccccc1n2 | InChi: | InChI=1S/C12H11NO2/c14-12(15)8-7-10-6-5-9-3-1-2-4-11(9)13-10/h1-6H,7-8H2,(H,14,15) | 定義日: | 2018-02-12 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 3-(quinolin-2-yl)propanoic acid |
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![OL3 OL3](https://data.pdbj.org/pdbjplus/data/cc/svg/OL3.svg) | OL3 | 表記: | N-biotin-C-Co4(mu3-O)4(OAc)(Py)4(H2O)3-beta-alanine | 組成式: | C35 H45 Co4 N7 O13 S | SMILES: | O.O.O.CC1O[Co]2O[Co](O1)O[Co]3OC(CCNC(=O)CCCC[CH]4SC[CH]5NC(=O)N[CH]45)O[Co](O2)O3.c6ccncc6.c7ccncc7.c8ccncc8.c9ccncc9 | InChi: | InChI=1S/C13H21N3O4S.4C5H5N.C2H4O2.4Co.3H2O.4O/c17-10(14-6-5-11(18)19)4-2-1-3-9-12-8(7-21-9)15-13(20)16-12 | 定義日: | 2017-09-20 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 |
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![OL4 OL4](https://data.pdbj.org/pdbjplus/data/cc/svg/OL4.svg) | OL4 | 表記: | N-biotin-C-Co4(mu3-O)4(Py)3(H2O)4-beta-alanine | 組成式: | C28 H36 Co4 N6 O12 S | SMILES: | O.O.O.O.O=C(CCCC[CH]1SC[CH]2NC(=O)N[CH]12)NCCC3O[Co]4O[Co]O[Co]O[Co](O3)O4.c5ccncc5.c6ccncc6.c7ccncc7 | InChi: | InChI=1S/C13H21N3O4S.3C5H5N.4Co.4H2O.4O/c17-10(14-6-5-11(18)19)4-2-1-3-9-12-8(7-21-9)15-13(20)16-12 | 定義日: | 2017-09-21 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 |
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![OL5 OL5](https://data.pdbj.org/pdbjplus/data/cc/svg/OL5.svg) | OL5 | 表記: | N-biotin-C-Co4(mu3-O)4(OAc)(Py)3(H2O)3-beta-alanine | 組成式: | C30 H40 Co4 N6 O13 S | SMILES: | O.O.O.CC1O[Co]2O[Co](O1)O[Co]3OC(CCNC(=O)CCCC[CH]4SC[CH]5NC(=O)N[CH]45)O[Co](O2)O3.c6ccncc6.c7ccncc7.c8ccncc8 | InChi: | InChI=1S/C13H21N3O4S.3C5H5N.C2H4O2.4Co.3H2O.4O/c17-10(14-6-5-11(18)19)4-2-1-3-9-12-8(7-21-9)15-13(20)16-12 | 定義日: | 2017-09-20 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 |
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![OLS OLS](https://data.pdbj.org/pdbjplus/data/cc/svg/OLS.svg) | OLS | 表記: | N-biotin-C-Co4(mu3-O)4(Py)4(H2O)4-beta-alanine | 組成式: | C33 H41 Co4 N7 O12 S | SMILES: | O.O.O.O.O=C(CCCC[CH]1SC[CH]2NC(=O)N[CH]12)NCCC3O[Co]4O[Co]O[Co]O[Co](O3)O4.c5ccncc5.c6ccncc6.c7ccncc7.c8ccncc8 | InChi: | InChI=1S/C13H21N3O4S.4C5H5N.4Co.4H2O.4O/c17-10(14-6-5-11(18)19)4-2-1-3-9-12-8(7-21-9)15-13(20)16-12 | 定義日: | 2017-09-20 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 |
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![9AJ 9AJ](https://data.pdbj.org/pdbjplus/data/cc/svg/9AJ.svg) | 9AJ | 表記: | 2-[3'-(hydroxymethyl)-1-methyl-5-({5-[(2S)-2-methyl-4-(oxetan-3-yl)piperazin-1-yl]pyridin-2-yl}amino)-6-oxo[1,6-dihydro[3,4'-bipyridine]]-2'-yl]-7,7-dimethyl-3,4,7,8-tetrahydro-2H-cyclopenta[4,5]pyrrolo[1,2-a]pyrazin-1(6H)-one | 組成式: | C37 H44 N8 O4 | SMILES: | c7c1CC(C)(C)Cc1n8CCN(c6nccc(C=2C=C(C(=O)N(C=2)C)Nc5ncc(N3CCN(CC3C)C4COC4)cc5)c6CO)C(c78)=O | InChi: | InChI=1S/C37H44N8O4/c1-23-18-42(27-21-49-22-27)9-10-43(23)26-5-6-33(39-17-26)40-30-13-25(19-41(4)35(30)47)28-7-8-38-34(29(28)20-46)45-12-11-44-31(36(45)48)14-24-15-37(2,3)16-32(24)44/h5-8,13-14,17,19,23,27,46H,9-12,15-16,18,20-22H2,1-4H3,(H,39,40)/t23-/m0/s1 | 定義日: | 2017-04-14 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 2-[3'-(hydroxymethyl)-1-methyl-5-({5-[(2S)-2-methyl-4-(oxetan-3-yl)piperazin-1-yl]pyridin-2-yl}amino)-6-oxo[1,6-dihydro[3,4'-bipyridine]]-2'-yl]-7,7-dimethyl-3,4,7,8-tetrahydro-2H-cyclopenta[4,5]pyrrolo[1,2-a]pyrazin-1(6H)-one |
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![9LH 9LH](https://data.pdbj.org/pdbjplus/data/cc/svg/9LH.svg) | 9LH | 表記: | Tunicamycin | 組成式: | C38 H62 N4 O16 | SMILES: | CC(C)CCCCCCCCCC=CC(=O)N[CH]1[CH](O)[CH](O)[CH](C[CH](O)[CH]2O[CH]([CH](O)[CH]2O)N3C=CC(=O)NC3=O)O[CH]1O[CH]4O[CH](CO)[CH](O)[CH](O)[CH]4NC(C)=O | InChi: | InChI=1S/C38H62N4O16/c1-19(2)13-11-9-7-5-4-6-8-10-12-14-24(46)40-27-31(51)28(48)22(55-37(27)58-36-26(39-20(3)44)30(50)29(49)23(18-43)56-36)17-21(45)34-32(52)33(53)35(57-34)42-16-15-25(47)41-38(42)54/h12,14-16,19,21-23,26-37,43,45,48-53H,4-11,13,17-18H2,1-3H3,(H,39,44)(H,40,46)(H,41,47,54)/b14-12+/t21-,22-,23-,26-,27-,28+,29-,30-,31-,32+,33-,34-,35-,36-,37+/m1/s1 | 定義日: | 2017-06-01 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | (~{E})-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-2-[(2~{R},3~{R},4~{R},5~{S},6~{R})-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-[(2~{R})-2-[(2~{R},3~{S},4~{R},5~{R})-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethyl]-4,5-bis(oxidanyl)oxan-3-yl]-13-methyl-tetradec-2-enamide |
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![9XE 9XE](https://data.pdbj.org/pdbjplus/data/cc/svg/9XE.svg) | 9XE | 表記: | 7-methoxy-3-methyl-2-[5-[4-(trifluoromethyloxy)phenyl]pyridin-3-yl]-1~{H}-quinolin-4-one | 組成式: | C23 H17 F3 N2 O3 | SMILES: | COc1ccc2c(NC(=C(C)C2=O)c3cncc(c3)c4ccc(OC(F)(F)F)cc4)c1 | InChi: | InChI=1S/C23H17F3N2O3/c1-13-21(28-20-10-18(30-2)7-8-19(20)22(13)29)16-9-15(11-27-12-16)14-3-5-17(6-4-14)31-23(24,25)26/h3-12H,1-2H3,(H,28,29) | 定義日: | 2017-07-25 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | 7-methoxy-3-methyl-2-[5-[4-(trifluoromethyloxy)phenyl]pyridin-3-yl]-1~{H}-quinolin-4-one |
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![A4B A4B](https://data.pdbj.org/pdbjplus/data/cc/svg/A4B.svg) | A4B | 表記: | [3-chloranyl-4-(2-methoxyphenyl)phenyl]methanamine | 組成式: | C14 H14 Cl N O | SMILES: | COc1ccccc1c2ccc(CN)cc2Cl | InChi: | InChI=1S/C14H14ClNO/c1-17-14-5-3-2-4-12(14)11-7-6-10(9-16)8-13(11)15/h2-8H,9,16H2,1H3 | 定義日: | 2017-08-14 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | [3-chloranyl-4-(2-methoxyphenyl)phenyl]methanamine |
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![A4N A4N](https://data.pdbj.org/pdbjplus/data/cc/svg/A4N.svg) | A4N | 表記: | [3-chloranyl-4-(2-methylphenyl)phenyl]methanamine | 組成式: | C14 H14 Cl N | SMILES: | Cc1ccccc1c2ccc(CN)cc2Cl | InChi: | InChI=1S/C14H14ClN/c1-10-4-2-3-5-12(10)13-7-6-11(9-16)8-14(13)15/h2-8H,9,16H2,1H3 | 定義日: | 2017-08-16 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | [3-chloranyl-4-(2-methylphenyl)phenyl]methanamine |
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![A4Q A4Q](https://data.pdbj.org/pdbjplus/data/cc/svg/A4Q.svg) | A4Q | 表記: | [3-chloranyl-4-(2-ethylphenyl)phenyl]methanamine | 組成式: | C15 H16 Cl N | SMILES: | CCc1ccccc1c2ccc(CN)cc2Cl | InChi: | InChI=1S/C15H16ClN/c1-2-12-5-3-4-6-13(12)14-8-7-11(10-17)9-15(14)16/h3-9H,2,10,17H2,1H3 | 定義日: | 2017-08-16 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | [3-chloranyl-4-(2-ethylphenyl)phenyl]methanamine |
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![A8Q A8Q](https://data.pdbj.org/pdbjplus/data/cc/svg/A8Q.svg) | A8Q | 表記: | [3-chloranyl-4-(2-propan-2-ylphenyl)phenyl]methylazanium | 組成式: | C16 H19 Cl N | SMILES: | CC(C)c1ccccc1c2ccc(C[NH3+])cc2Cl | InChi: | InChI=1S/C16H18ClN/c1-11(2)13-5-3-4-6-14(13)15-8-7-12(10-18)9-16(15)17/h3-9,11H,10,18H2,1-2H3/p+1 | 定義日: | 2017-08-17 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | [3-chloranyl-4-(2-propan-2-ylphenyl)phenyl]methylazanium |
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![2IL 2IL](https://data.pdbj.org/pdbjplus/data/cc/svg/2IL.svg) | 2IL | 表記: | (3R)-3-(dodecanoyloxy)tetradecanoic acid | 組成式: | C26 H50 O4 | SMILES: | O=C(O)CC(OC(=O)CCCCCCCCCCC)CCCCCCCCCCC | InChi: | InChI=1S/C26H50O4/c1-3-5-7-9-11-13-15-17-19-21-24(23-25(27)28)30-26(29)22-20-18-16-14-12-10-8-6-4-2/h24H,3-23H2,1-2H3,(H,27,28)/t24-/m1/s1 | 定義日: | 2012-07-10 | 最終更新日: | 2018-02-23 | 公開日: | 2018-02-28 | 識別子(ID): | (3R)-3-(dodecanoyloxy)tetradecanoic acid |
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