DTXSID201005803
[(8S,9S,10R,13S,14S,17R)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Identity
DTXSID201005803
[(8S,9S,10R,13S,14S,17R)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
PubChem CID: 9895694
2D Structure
Properties
C41H54O6
Molecular Formula
642.90
Molecular Weight
g/mol
642.3920
Exact Mass
Da
101
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
1160
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(14)
DTXSID2010058036-Methyl-3,20-dioxo-19-norpregna-4,6-dien-17-yl acetate--estra-1(10),2,4-triene-3,17-diol (1/1)RefChem:1074062DTXCID101432681NaemisNOMAC-E2NOMAC/E2Estradiol and nomegestrol acetate853244-42-517beta-Estradiol-nomegestrol acetate mixt.17beta-Estradiol - nomegestrol acetate mixt.SCHEMBL29624833[(8S,9S,10R,13S,14S,17R)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol6-Methyl-3,20-dioxo-19-norpregna-4,6-dien-17-yl acetate--estra-1(10),2,4-triene-3,17beta-diol (1/1)
Data from PubChem (NCBI)
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