Molecular Identity
Atamestane
(8R,9S,10S,13S,14S)-1,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
PubChem CID: 57050
2D Structure
Properties
C20H26O2
Molecular Formula
298.40
Molecular Weight
g/mol
298.1933
Exact Mass
Da
2.9
XLogP
Drug-like (Lipinski: < 5)
34.1
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
2
H-Bond Acceptors
626
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=O)C=C2C1(C3CCC4(C(C3CC2)CCC4=O)C)CIsomeric SMILES
SMILES: CC1=CC(=O)C=C2[C@]1([C@H]3CC[C@]4([C@H]([C@@H]3CC2)CCC4=O)C)CSynonyms(20)
ATAMESTANE96301-34-7AtamestanoAtamestanum1-Methylandrosta-1,4-diene-3,17-dioneSH-489Androsta-1,4-diene-3,17-dione, 1-methyl-62GA3K28B61-methyl-1,4-androstadiene-3,17-dioneDTXSID30869268SH489RefChem:115401DTXCID901519069(1S,2S,10R,11S,15S)-2,3,15-trimethyltetracyclo(8.7.0.0^(2,7).0^(11,15))heptadeca-3,6-diene-5,14-dioneAtamestane [INN]
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Atamestane
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