Chemical Compound

4-cholenic acid-3-one

CAS Registry Number 1452-29-5
4-cholenic acid-3-one chemical structure
Primary Record

4-cholenic acid-3-one

In stock
874 g
Purity
98.1 %
CAS
1452-29-5

Compound Identifiers & Properties

CAS
1452-29-5
PubChem CID
5283990
SMILES
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C
Canonical SMILES
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

Names & Synonyms

  • 4-cholenic acid-3-one
  • 3-Oxochol-4-en-24-oic acid
  • 3-oxo-4-cholenoic acid
  • AC1NR3I0
  • 3-oxochol-4-ene-24-oic acid
  • SCHEMBL1655219
  • 3-Oxochola-4-ene-24-oic acid
  • CHEBI:176827
  • 2-Pyridinecarboxylic acid, hydrazide
  • LMST04010233
  • ZINC13547274
  • CID5283990
  • J1.898.089D
  • (4R)-4-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
  • 1452-29-5
  • "(R)-4-((8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid"
  • (4R)-4-[(1R,3aS,3bS,9aR,9bS,11aR)-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]pentanoic acid
  • (R)-4-((8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid