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Structure

5α-Pregnan-3α,11β,17,21-tetrol-20-one 3,21-diacetate

CAS
4004-70-0
Catalog Number
ACM4004700
Category
Steroidal Compounds
Molecular Weight
450.57
Molecular Formula
C25H38O7

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Specification

Synonyms
ALLO TH 'F' DIACETATE;5-ALPHA-PREGNAN-3-ALPHA, 11-BETA, 17,21-TETROL-20-ONE 3,21-DIACETATE
IUPAC Name
[2-[(3R,5S,8S,9S,10S,11S,13S,14S,17R)-3-acetyloxy-11,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Canonical SMILES
CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4C3(CCC(C4)OC(=O)C)C)O)C)O
InChI Key
QGAODEALOJFHBD-UZMCWQCBSA-N
Exact Mass
450.26200
H-Bond Acceptor
7
H-Bond Donor
2
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