CAS
7252-85-9 Purity
96%
7252-85-9 Purity
96%
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5-Beta-pregnan-3-alpha,11-beta,17-triol-20-one
CAS
7252-91-7
Catalog Number
ACM7252917
Category
Other Products
Molecular Weight
350.49
Molecular Formula
C21H34O4
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Specification
Synonyms
5BETA-PREGNAN-3ALPHA,11BETA,17ALPHA-TRIOL-20-ONE;5-BETA-PREGNAN-3-ALPHA, 11-BETA, 17-TRIOL-20-ONE;3ALPHA,11B,17ALPHA-Trihydroxy-5B-pregnan-20-one
IUPAC Name
1-[(3R,5R,8S,9S,10S,11S,13S,14S,17R)-3,11,17-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Canonical SMILES
CC(=O)C1(CCC2C1(CC(C3C2CCC4C3(CCC(C4)O)C)O)C)O
InChI Key
VHYUGQIWISVBRT-SUTVCERISA-N
Boiling Point
504.6ºC at 760 mmHg
Flash Point
273ºC
Density
1.189g/cm³
Exact Mass
350.24600
H-Bond Acceptor
4
H-Bond Donor
3
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