GANAXOLONE
1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Molecular Identity
GANAXOLONE
1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone
PubChem CID: 6918305
Ganaxolone is a corticosteroid hormone.
2D Structure
Properties
C22H36O2
Molecular Formula
332.50
Molecular Weight
g/mol
332.2715
Exact Mass
Da
5
XLogP
Above Lipinski threshold
37.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
542
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
GANAXOLONE38398-32-2ZtalmyCCD 10423alpha-Hydroxy-3beta-methyl-5alpha-pregnan-20-oneCCD-1042ganaxolonaCCD104298WI44OHIQDTXSID6046503DEA NO. 2401DTXCID4026503Pregnan-20-one, 3-hydroxy-3-methyl-, (3alpha,5alpha)-ganaxolonumRefChem:57127
Data from PubChem (NCBI)
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