Chemical Compound

(3S,6S,9S,12S)-3-((4-buta-2,3-dienoxyphenyl)methyl)-9-((4-((E)-but-2-enoxy)-2-hydroxyphenyl)methyl)-1,7-dimethyl-6,12-bis(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone

(3S,6S,9S,12S)-3-((4-buta-2,3-dienoxyphenyl)methyl)-9-((4-((E)-but-2-enoxy)-2-hydroxyphenyl)methyl)-1,7-dimethyl-6,12-bis(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone 结构式
Primary record

(3S,6S,9S,12S)-3-((4-buta-2,3-dienoxyphenyl)methyl)-9-((4-((E)-but-2-enoxy)-2-hydroxyphenyl)methyl)-1,7-dimethyl-6,12-bis(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
139583199
SMILES
C/C=C/COC1=CC(=C(C=C1)C[C@H]2C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2)CC(C)C)C)CC3=CC=C(C=C3)OCC=C=C)CC(C)C)C)O
Canonical SMILES
C=C=CCOc1ccc(C[C@@H]2NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc3ccc(OC/C=C/C)cc3O)NC(=O)[C@H](CC(C)C)N(C)C2=O)cc1

名称与同义词

  • (E)-pseudoxylallemycin F
  • RefChem:70057
  • CHEBI:197890
  • (3S,6S,9S,12S)-3-((4-buta-2,3-dienoxyphenyl)methyl)-9-((4-((E)-but-2-enoxy)-2-hydroxyphenyl)methyl)-1,7-dimethyl-6,12-bis(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
  • (3S,6S,9S,12S)-3-[(4-buta-2,3-dienoxyphenyl)methyl]-9-[[4-[(E)-but-2-enoxy]-2-hydroxyphenyl]methyl]-1,7-dimethyl-6,12-bis(2-methylpropyl)-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone