Chem
J-GLOBAL ID:200907002713022198
Nikkaji number:J354.037E
3α,6β-Dihydroxy-1-methylene-5α-androstan-17-one
3α,6β-ジヒドロキシ-1-メチレン-5α-アンドロスタン-17-オン
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Substance type:
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
Molecular formula:
C20 H30 O3
Molecular formula furigana:
C20-H30-O3
Molecular weight:
318.457
InChI:
InChI=1S/C20H30O3/c1-11-8-12(21)9-16-17(22)10-13-14-4-5-18(23)19(14,2)7-6-15(13)20(11,16)3/h12-17,21-22H,1,4-10H2,2-3H3/t12-,13+,14+,15+,16-,17-,19+,20-/m1/s1
InChI key:
SCUQLRXKLLRTNR-QMIGJMKVSA-N
SMILES:
C[C@]12CC[C@H]3[C@@H](C[C@@H](O)[C@H]4C[C@H](O)CC(=C)[C@]34C)[C@@H]1CCC2=O
Systematic name (3):
3α,6β-ジヒドロキシ-1-メチレン-5α-アンドロスタン-17-オン
(3aS,3bR,5R,5aS,7S,9aR,9bS,11aS)-5,7-ジヒドロキシ-9a,11a-ジメチル-9-メチリデン-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,5R,5aS,7S,9aR,9bS,11aS)-5,7-dihydroxy-9a,11a-dimethyl-9-methylidene-hexadecahydro-1H-cyclopenta[a]phenanthren-1-one
Other name (1):
3α,6β-Dihydroxy-1-methylene-5α-androstan-17-one
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