Chemical Compound

3-oxo-cholyl-CoA

3-oxo-cholyl-CoA chemical structure
Primary Record

3-oxo-cholyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
25202182
SMILES
CC(CCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O)C4CCC5C4(C(CC6C5C(CC7C6(CCC(=O)C7)C)O)O)C
Canonical SMILES
CC(CCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)([O-])[O-])C1CCC2C3C(O)CC4CC(=O)CCC4(C)C3CC(O)C12C

Names & Synonyms

  • 3-oxo-cholyl-CoA
  • 3-oxo-choloyl-CoA
  • LMFA07050238
  • 7-alpha,12-alpha-dihydroxy-3-oxo-4-cholenyl-CoA
  • [5-(6-aminopurin-9-yl)-2-[[[[4-[[3-[2-[4-(7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoylsulfanyl]ethylamino]-3-oxo-propyl]amino]-3-hydroxy-2,2-dimethyl-4-oxo-butoxy]-oxido-phosphoryl]oxy-oxido-phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-3-yl] phosphate