Chemical Compound

24-Oxo-DHC-CoA

24-Oxo-DHC-CoA chemical structure
Primary Record

24-Oxo-DHC-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
46224539
SMILES
C[C@H](CCC(=O)C(C)C(=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)[C@H]4CC[C@@H]5[C@@]4(CC[C@H]6[C@H]5[C@@H](C[C@H]7[C@@]6(CC[C@H](C7)O)C)O)C
Canonical SMILES
CC(C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=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

  • 24-Oxo-DHC-CoA
  • CHEBI:28533
  • J1.490.191D
  • C05449
  • 3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA
  • 3alpha,7alpha-Dihydroxy-5beta-24-oxocholestanoyl-CoA
  • Q27103760
  • 3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-coenzyme A
  • 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • S-(3alpha,7alpha-Dihydroxy-24-oxo-26-oxo-5beta-cholestane-26-yl)coenzyme A
  • {[(2R,3S,4R,5R)-2-({[({[(3R)-3-({2-[(2-{[(6R)-6-[(1R,3aS,3bR,4R,5aS,7R,9aS,9bS,11aR)-4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-oxoheptanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
  • Adenosine 5 -[diphosphoric acid beta-[(R)-4-[[2-[[2-(3alpha,7alpha-dihydroxy-24,26-dioxo-5beta-cholestane-26-ylthio)ethyl]carbamoyl]ethyl]amino]-4-oxo-3-hydroxy-2,2-dimethylbutyl]]3 -phosphoric acid