Chemical Compound

3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}

3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 结构式
Primary record

3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
90659899
SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCCCCCC/C=C\C/C=C\CCCCCO)O
Canonical SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCC/C=C\C/C=C\CCCCCO

名称与同义词

  • RefChem:69844
  • 18-hydroxylinoleoyl-CoA
  • CHEBI:85508
  • (9Z,12Z)-18-hydroxyoctadecadienoyl-CoA
  • (9Z,12Z)-18-hydroxyoctadecadienoyl-coenzyme A
  • (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl-CoA
  • C21006
  • (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl-coenzyme A
  • Q27158611
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-4-((3-((2-(((9Z,12Z)-18-hydroxyoctadeca-9,12-dienoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)