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CAS RN 1553-56-6

CH3(R)HOO(R)(S)(R)(R)O(S)H3C(S)(R)H3C

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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