Methyl 3alpha-[(ethoxycarbonyl)oxy]-12-oxo-5-beta-cholan-24-oate

CAS

83918-75-6

Catalog Number

ACM83918756

Category

Other Products

Molecular Weight

476.645360 [g/mol]

Molecular Formula

C₂₈H₄₄O₆

MSDS COA Spec Sheet

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Specification

Synonyms

NSC81203, EINECS 281-311-0, CID10624431, Methyl 3alpha-((ethoxycarbonyl)oxy)-12-oxo-5-beta-cholan-24-oate, 83918-75-6

IUPAC Name

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

Canonical SMILES

CCOC(=O)OC1CCC2(C(C1)CCC3C2CC(=O)C4(C3CCC4C(C)CCC(=O)OC)C)C

InChI Key

IIKAPKMDLLYVKL-XBBAIHCVSA-N

EC Number

281-311-0

Exact Mass

476.31400

H-Bond Acceptor

H-Bond Donor

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