Chemical Compound

(2R,3S,4S)-4-(((2S,3S)-3-amino-2-(((2R,3R)-2-((2-(((2S,3R,4Z,6E,8R)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((3R,6S,9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((R)-(4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide

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(2R,3S,4S)-4-(((2S,3S)-3-amino-2-(((2R,3R)-2-((2-(((2S,3R,4Z,6E,8R)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((3R,6S,9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((R)-(4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide 结构式
Primary record

(2R,3S,4S)-4-(((2S,3S)-3-amino-2-(((2R,3R)-2-((2-(((2S,3R,4Z,6E,8R)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((3R,6S,9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((R)-(4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
24866565
SMILES
CC[C@@H](C)/C=C(\C)/C=C\[C@H]([C@@](C)(C(=O)NCC(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H]([C@H](C)N)C(=O)N[C@@H]([C@@H](C)[C@@H](C)C(=O)N)C(=O)N[C@@H]1[C@H](OC(=O)[C@@H]2CCCCN2C(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](NC1=O)COC)C)[C@@H](C)O)[C@@H](C3=CC=C(C=C3)O)OC)C(C)C)O)O
Canonical SMILES
CC[C@@H](C)/C=C(C)/C=C\[C@@H](O)[C@](C)(O)C(=O)NCC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]1C(=O)N[C@H](COC)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H]([C@H](OC)c2ccc(O)cc2)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]1C(C)C)[C@@H](C)[C@@H](C)C(N)=O)[C@H](C)N)[C@@H](C)O

名称与同义词

  • Papuamide B
  • RefChem:169935
  • CHEBI:83265
  • Q27156714
  • (2R,3S,4S)-4-(((2S,3R)-3-amino-2-(((2S,3R)-2-((2-(((4Z,6E)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((3R,9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((R)-(4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide
  • (2R,3S,4S)-4-(((2S,3S)-3-amino-2-(((2R,3R)-2-((2-(((2S,3R,4Z,6E,8R)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((3R,6S,9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((R)-(4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide
  • (2R,3S,4S)-4-(((2S,3S)-3-amino-2-(((2R,3R)-2-((2-(((4Z,6E)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl)amino)acetyl)amino)-3-hydroxybutanoyl)amino)butanoyl)amino)-N'-((9S,15R,18R,19R,22S)-6-((1R)-1-hydroxyethyl)-3-((4-hydroxyphenyl)-methoxymethyl)-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo(20.4.0)hexacosan-18-yl)-2,3-dimethylpentanediamide
  • (2R,3S,4S)-4-[[(2S,3S)-3-Amino-2-[[(2R,3R)-2-[[2-[[(2S,3R,4Z,6E,8R)-2,3-dihydroxy-2,6,8-trimethyldeca-4,6-dienoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]butanoyl]amino]-N'-[(3R,6S,9S,15R,18R,19R,22S)-6-[(1R)-1-hydroxyethyl]-3-[(R)-(4-hydroxyphenyl)-methoxymethyl]-15-(methoxymethyl)-9-methyl-2,5,8,11,14,17,21-heptaoxo-19-propan-2-yl-20-oxa-1,4,7,10,13,16-hexazabicyclo[20.4.0]hexacosan-18-yl]-2,3-dimethylpentanediamide