Chem
J-GLOBAL ID：200907067189111425
Nikkaji number：J2.330.107E
3,3-Dihydroperoxyandrostane-17-one
3,3-ジヒドロペルオキシアンドロスタン-17-オン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C19H30O5
Molecular formula furigana： C19-H30-O5
Molecular weight： 338.444
InChI：
InChI=1S/C19H30O5/c1-17-9-10-19(23-21,24-22)11-12(17)3-4-13-14-5-6-16(20)18(14,2)8-7-15(13)17/h12-15,21-22H,3-11H2,1-2H3/t12?,13-,14-,15-,17-,18-/m0/s1
InChI key：
ZJCAXTDFJYXOEK-NOHRQJBMSA-N
SMILES：
C[C@]12CC[C@H]3[C@@H](CCC4CC(CC[C@]34C)(OO)OO)[C@@H]1CCC2=O
Systematic name (4)：
- 3,3-ジヒドロペルオキシアンドロスタン-17-オン
- 3,3-ビス(ヒドロペルオキシ)アンドロスタン-17-オン
- (3aS,3bR,9aS,9bS,11aS)-7,7-ジヒドロペルオキシ-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1-オン
- (3aS,3bR,9aS,9bS,11aS)-7,7-dihydroperoxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-one
- 3,3-Dihydroperoxyandrostane-17-one
- 3,3-Bis(hydroperoxy)androstane-17-one
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