Structure

Renanolone

CAS
565-99-1
Catalog Number
ACM565991
Category
Other Products
Molecular Weight
332.481
Molecular Formula
C21H32O3

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Specification

Synonyms
Renanolone, Alfaxalone, Renanolona, Renanolonum, 11-Oxopregnanolone, 11-Ketopregnanolone, 5-beta-Alphaxalone, Renanolone [INN], Renanolonum [INN-Latin], Renanolona [INN-Spanish], UNII-D8Z6E4IR2J, 3alpha-Hydroxy-11,20-pregnadien, NSC 82859, C21H32O3, CID68930, NSC82859, alphaxalone, (3alpha,5beta)-isomer, 3alpha-Hydroxy-5beta-pregnane-11,20-dione, 3-alpha-Hydroxy-5-beta-pregnane-11,20-dione, U 1894
IUPAC Name
(3R,5R,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
Canonical SMILES
CC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C
InChI Key
DUHUCHOQIDJXAT-CSXWOMMHSA-N
Boiling Point
504ºC at 760mmHg
Flash Point
272.7ºC
Density
1.212g/cm³
Exact Mass
332.23500
H-Bond Acceptor
3
H-Bond Donor
1
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