Chemical Compound

3-Oxododecanoyl-CoA

CAS Registry Number 78303-19-2
3-Oxododecanoyl-CoA chemical structure
Primary Record

3-Oxododecanoyl-CoA

In stock
7,119 g
Purity
99.8 %
CAS
78303-19-2

Compound Identifiers & Properties

CAS
78303-19-2
PubChem CID
440604
SMILES
CCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(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
CCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(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

  • 3-Oxododecanoyl-CoA
  • 3-oxolauroyl-CoA
  • RefChem:1076211
  • 3-oxododecanoyl-coenzyme A
  • DTXSID20331505
  • AC1L99M9
  • CTK5E5646
  • DTXCID30282599
  • Coenzyme A,S-(3-oxododecanoate)
  • AG-H-14200
  • Coenzyme A, S-(3-oxododecanoate)
  • CID440604
  • J2.755.092D
  • 3-Oxododecanoyl-CoA; (Acyl-CoA); [M+H]+;
  • C05263
  • 78303-19-2
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(3-oxododecanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid P2-[2,2-dimethyl-3-hydroxy-3-[[2-[[2-(1,3-dioxododecylthio)ethyl]aminocarbonyl]ethyl]aminocarbonyl]propyl]] ester
  • S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxododecanethioate
  • S-{1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} 3-oxododecanethioate