Duavee
1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol;[(9S,13S,14S)-13-methyl-17-oxo-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate;[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate;[(13S,14S)-13-methyl-17-oxo-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
Molecular Identity
Duavee
1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol;[(9S,13S,14S)-13-methyl-17-oxo-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate;[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate;[(13S,14S)-13-methyl-17-oxo-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
PubChem CID: 85364158
2D Structure
Properties
C84H94N2O18S3
Molecular Formula
1515.80
Molecular Weight
g/mol
1514.5664
Exact Mass
Da
325
TPSA
May have limited oral absorption
5
H-Bond Donors
19
H-Bond Acceptors
2550
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(7)
DuaveeBazedoxifene/conjugated estrogensSCHEMBL29373865Bazedoxifene / conjugated estrogensBazedoxifene and conjugated estrogensQ16274732S900006280
Data from PubChem (NCBI)
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