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Structure

5β-Pregnan-3α,11β,17,20α-tetrol

CAS
1242-48-4
Catalog Number
ACM1242484
Category
Steroidal Compounds
Molecular Weight
352.51
Molecular Formula
C21H36O4

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Specification

Synonyms
PREGNANETETROL;5-BETA-PREGNAN-3-ALPHA, 11-ALPHA, 17,20-ALPHA-TETROL;5BETA-PREGNAN-3ALPHA,11BETA,17ALPHA,20ALPHA-TETROL;5 beta-pregnane-3 alpha,11 beta,17,20 alpha-tetrol;3ALPHA,11B,17ALPHA,20ALPHA-Tetrahydroxy-5B-pregnane;(3R,5R,8S,9S,10S,11S,13S,14S,17R
IUPAC Name
(3R,5R,8S,9S,10S,11S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,11,17-triol
Canonical SMILES
CC(C1(CCC2C1(CC(C3C2CCC4C3(CCC(C4)O)C)O)C)O)O
InChI Key
CQRHDJNAPDZBCN-ZCXVUIRUSA-N
Boiling Point
508.7ºC at 760mmHg
Flash Point
227.5ºC
Density
1.188g/cm³
Exact Mass
352.26100
H-Bond Acceptor
4
H-Bond Donor
4
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