Chemical Compound

3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(13Z,16Z,19Z,22Z)-3-oxooctacosa-13,16,19,22-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}

3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(13Z,16Z,19Z,22Z)-3-oxooctacosa-13,16,19,22-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} 结构式
Primary record

3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(13Z,16Z,19Z,22Z)-3-oxooctacosa-13,16,19,22-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
71581152
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(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-])O
Canonical SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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-]

名称与同义词

  • CHEBI:74283
  • 3-oxo-C28:4(omega-6)-CoA(4-)
  • (13Z,16Z,19Z,22Z)-3-oxooctacosatetraenoyl-CoA(4-)
  • (13Z,16Z,19Z,22Z)-3-oxooctacosatetraenoyl-CoA
  • Q27144573
  • (13Z,16Z,19Z,22Z)-3-ketooctacosatetraenoyl-CoA(4-)
  • (13Z,16Z,19Z,22Z)-3-ketooctacosatetraenoyl-coenzyme A(4-)
  • (13Z,16Z,19Z,22Z)-3-oxooctacosatetraenoyl-coenzyme A(4-)
  • 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(13Z,16Z,19Z,22Z)-3-oxooctacosa-13,16,19,22-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}