Chemical Compound

(13Z)-3-oxodocosenoyl-CoA

(13Z)-3-oxodocosenoyl-CoA chemical structure
Primary Record

(13Z)-3-oxodocosenoyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
71581044
SMILES
CCCCCCCC/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
CCCCCCCC/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

Names & Synonyms

  • (13Z)-3-oxodocosenoyl-CoA
  • (13Z)-3-ketodocosenoyl-CoA
  • RefChem:68252
  • (13Z)-3-oxodocosenoyl-coenzyme A
  • (13Z)-3-ketodocosenoyl-coenzyme A
  • 3-oxo-13Z-docosenoyl-CoA
  • CHEBI:74127
  • LMFA07050096
  • Q27144436
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(13Z)-3-oxodocos-13-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
  • 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-2,2-dimethyl-4-((3-((2-(((13Z)-3-oxodocos-13-enoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-4-oxobutyl) dihydrogen diphosphate)