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Structure

5α-Pregnane-3β,20(S)-diol

CAS
566-56-3
Catalog Number
ACM566563
Category
Steroidal Compounds
Molecular Weight
320.51
Molecular Formula
C21H36O2

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Specification

Synonyms
5-ALPHA-PREGNAN-3-BETA, 20-ALPHA-DIOL;5-alpha-pregnane-3-beta,20-alpha-diol;5A-PREGNANE-3B-20A-DIOL;Allopregnane-3B,20ALPHA-diol;allopregnane-3beta,20alpha-diol;(3S,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,1
IUPAC Name
(3S,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES
CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O
InChI Key
YWYQTGBBEZQBGO-ZVPCKFNKSA-N
Boiling Point
435.9ºC at 760 mmHg
Flash Point
191ºC
Density
1.053 g/cm³
EC Number
209-296-8
Exact Mass
320.27200
H-Bond Acceptor
2
H-Bond Donor
2
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