Chemical Compound

dehydrocholic acid

CAS Registry Number 81-23-2
dehydrocholic acid chemical structure
Primary Record

dehydrocholic acid

In stock
8,696 g
Purity
99.1 %
CAS
81-23-2

Compound Identifiers & Properties

CAS
81-23-2
PubChem CID
9822404
SMILES
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2C(=O)CC4[C@@]3(CCC(=O)C4)C)C
Canonical SMILES
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(=O)CC4CC(=O)CC[C@]4(C)[C@H]3CC(=O)[C@]12C

Names & Synonyms

  • dehydrocholic acid
  • dehydrocholicacid
  • 3,7,12-Triketocholansaure
  • Purified dehydrocholic acid
  • SCHEMBL26392
  • C24H34O5
  • MFCD00066410
  • 3,7,12-Trioxocholane-24-oic acid
  • AKOS016001316
  • CID9822404
  • 24-Hydroxycholane-3,7,12,24-tetraone
  • K445
  • 81-23-2
  • J2.395.660H
  • 7276-59-7
  • (4R)-4-[(1R,3aS,3bR,9aS,9bS,11aR)-9a,11a-dimethyl-4,7,11-trioxo-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
  • (4R)-4-[(8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid