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Home/Compounds/API/(R)-4-((3R,5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
C26H42O4
418.6 g/mol
API

(R)-4-((3R,5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

CAS915038-26-5
Category
API
Compound Class
Steroid
Primary Use
Pharmaceutical Raw Material

This compound is a steroidal acid derivative used as an active pharmaceutical ingredient in pharmaceutical manufacturing. It is identified by a complex polycyclic structure containing both carboxylic acid and alcohol functional groups.

Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.

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Related Compounds

SimilarStructure SimilarSimilarity 0.80

Ethyl (4R)-4-[(3R,5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

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Referencestereoisomer of

Cholan-24-oic acid, 6-ethyl-3-hydroxy-7-oxo-, (3α,5β)-

CAS1892540-33-8

pharmaceutical raw material

Referencesame scaffold

Nutriacholic acid

CAS4651-67-6

pharmaceutical raw material

Referencesame scaffold

3alpha-Hydroxy-7-oxo-5beta-cholan-24-oic acid methyl ester

CAS10538-59-7

pharmaceutical intermediate

Identifiers
IUPAC Name

(4R)-4-[(3R,5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid

InChIKey

LHSZAKRHUYJKIU-CNFLPKCYSA-N

SMILES

CC[C@@H]1[C@@H]2C[C@@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C1=O)CC[C@@H]4[C@H](C)CCC(=O)O)C)C)O

Synonyms (16)
  • Obeticholic Acid Impurity I