Chemical Compound

3-Oxopalmitoyl-CoA

CAS Registry Number 34619-89-1
3-Oxopalmitoyl-CoA chemical structure
Primary Record

3-Oxopalmitoyl-CoA

In stock
6,465 g
Purity
99.2 %
CAS
34619-89-1

Compound Identifiers & Properties

CAS
34619-89-1
PubChem CID
169621
SMILES
CCCCCCCCCCCCCC(=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
CCCCCCCCCCCCCC(=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

  • 3-Oxopalmitoyl-CoA
  • 3-ketopalmitoyl-CoA
  • 3-Oxohexadecanoyl-CoA
  • 3-Oxopalmitoyl CoA
  • beta-Ketohexadecanoyl-coenzyme A
  • beta-Ketopalmitoyl-CoA
  • 3-Ketohexadecanoyl CoA
  • 3-?Ketopalmitoyl-?CoA
  • SCHEMBL380634
  • Coenzyme A, S-(3-oxohexadecanoate)
  • S-(3-Oxopalmitoyl)coenzyme A
  • AC1L543F
  • SCHEMBL31475488
  • CHEBI:15491
  • 34619-89-1
  • C37H64N7O18P3S
  • DTXSID501297136
  • Coenzyme A, beta-ketohexadecanoyl-
  • AR-1L3758
  • CID169621
  • LMFA07050250
  • 3,3-dichloro-5-ethyl-dihydro-furan-2-one
  • 3-oxohexadecanoic acid coenzyme A thioester
  • J757.173I
  • C05259
  • S-[2-[3-[[(2R)-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-oxohexadecanethioate
  • Q27089474
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(3-oxohexadecanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
  • 39251-01-9
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-(3-oxopalmitoylthio)ethyl]amino]-3-oxopropyl]amino]-4-oxobutyl]] ester
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-4-[[3-[[2-(3-oxohexadecanoylthio)ethyl]amino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutyl]] ester
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl] 3-oxohexadecanethioate
  • S-{(9R)-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-oxohexadecanethioate
  • s-{(9r)-1-[(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3|E5,5|E5-diphosphaheptadecan-17-yl} 3-oxohexadecanethioate(non-preferred name)