CAS RN 1553-56-6
CAS RN 1553-56-6
IUPAC Name:
(4R)-4-[(1R,3aS,3bR,5aR,9aS,9bS,11aR)-9a,11a-dimethyl-7-oxo-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
Synonyms:
3-ketolithocholic acid 3-oxocholan-24-oic acid
Molecular Weight (g/mol):
374.57
Molecular Formula:
C24H38O3
InChi Key:
KIQFUORWRVZTHT-OPTMKGCMSA-N
SMILES:
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
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3-Oxo-5beta-cholanoic Acid 95.0+%, TCI America™

CAS: 1553-56-6 Molecular Formula: C24H38O3 Molecular Weight (g/mol): 374.565 MDL Number: MFCD00046265 InChI Key: KIQFUORWRVZTHT-OPTMKGCMSA-N PubChem CID: 5283906 ChEBI: CHEBI:17639 IUPAC Name: (4R)-4-[(5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C