Chemical Compound

(S)-ibuprofenoyl-CoA, 20; (Acyl-CoA); [M+H]+;

(S)-ibuprofenoyl-CoA, 20; (Acyl-CoA); [M+H]+; 结构式
Primary record

(S)-ibuprofenoyl-CoA, 20; (Acyl-CoA); [M+H]+;

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
24776375
SMILES
CCC(C)C1=CC=C(C=C1)[C@H](C)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O)O)O
Canonical SMILES
CCC(C)c1ccc([C@H](C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)cc1

名称与同义词

  • (S)-ibuprofenoyl-CoA, 20
  • BDBM21733
  • (S)-ibuprofenoyl-CoA, 20; (Acyl-CoA); [M+H]+;