Chemical Compound

((2R)-1-((6S,13S,19S,25E,28S,31Z,34S,37S)-6-(3-amino-3-oxopropyl)-34-benzyl-25,31-di(ethylidene)-9-hydroxy-22-(1-hydroxyethyl)-28-(hydroxymethyl)-2,5,8,12,18,21,24,27,30,33,36-undecaoxo-19-(2-phenylethyl)-1,4,7,11,17,20,23,26,29,32,35-undecazatricyclo(35.3.0.013,17)tetracontan-10-yl)-4,5-dihydroxy-7-methyloctan-2-yl) (2S)-2-(acetyl(methyl)amino)-4-methylpentanoate

((2R)-1-((6S,13S,19S,25E,28S,31Z,34S,37S)-6-(3-amino-3-oxopropyl)-34-benzyl-25,31-di(ethylidene)-9-hydroxy-22-(1-hydroxyethyl)-28-(hydroxymethyl)-2,5,8,12,18,21,24,27,30,33,36-undecaoxo-19-(2-phenylethyl)-1,4,7,11,17,20,23,26,29,32,35-undecazatricyclo(35.3.0.013,17)tetracontan-10-yl)-4,5-dihydroxy-7-methyloctan-2-yl) (2S)-2-(acetyl(methyl)amino)-4-methylpentanoate 结构式
Primary record

((2R)-1-((6S,13S,19S,25E,28S,31Z,34S,37S)-6-(3-amino-3-oxopropyl)-34-benzyl-25,31-di(ethylidene)-9-hydroxy-22-(1-hydroxyethyl)-28-(hydroxymethyl)-2,5,8,12,18,21,24,27,30,33,36-undecaoxo-19-(2-phenylethyl)-1,4,7,11,17,20,23,26,29,32,35-undecazatricyclo(35.3.0.013,17)tetracontan-10-yl)-4,5-dihydroxy-7-methyloctan-2-yl) (2S)-2-(acetyl(methyl)amino)-4-methylpentanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
44423112
SMILES
C/C=C\1/C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)NC(C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N1)CC4=CC=CC=C4)CCC(=O)N)O)C[C@H](CC(C(CC(C)C)O)O)OC(=O)[C@H](CC(C)C)N(C)C(=O)C)CCC5=CC=CC=C5)C(C)O)CO
Canonical SMILES
C/C=C1\NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)C(O)C(C[C@H](CC(O)C(O)CC(C)C)OC(=O)[C@H](CC(C)C)N(C)C(C)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCc2ccccc2)NC(=O)C(C(C)O)NC(=O)/C(=C\C)NC(=O)[C@H](CO)NC1=O

名称与同义词

  • pahayokolides A
  • RefChem:169595
  • CHEMBL266434
  • ((2R)-1-((6S,13S,19S,25E,28S,31Z,34S,37S)-6-(3-amino-3-oxopropyl)-34-benzyl-25,31-di(ethylidene)-9-hydroxy-22-(1-hydroxyethyl)-28-(hydroxymethyl)-2,5,8,12,18,21,24,27,30,33,36-undecaoxo-19-(2-phenylethyl)-1,4,7,11,17,20,23,26,29,32,35-undecazatricyclo(35.3.0.013,17)tetracontan-10-yl)-4,5-dihydroxy-7-methyloctan-2-yl) (2S)-2-(acetyl(methyl)amino)-4-methylpentanoate
  • [(2R)-1-[(6S,13S,19S,25E,28S,31Z,34S,37S)-6-(3-amino-3-oxopropyl)-34-benzyl-25,31-di(ethylidene)-9-hydroxy-22-(1-hydroxyethyl)-28-(hydroxymethyl)-2,5,8,12,18,21,24,27,30,33,36-undecaoxo-19-(2-phenylethyl)-1,4,7,11,17,20,23,26,29,32,35-undecazatricyclo[35.3.0.013,17]tetracontan-10-yl]-4,5-dihydroxy-7-methyloctan-2-yl] (2S)-2-[acetyl(methyl)amino]-4-methylpentanoate