Chem
J-GLOBAL ID：201007061118147618   Nikkaji number：J2.791.427F

2α-(Hydroxymethyl)-17-methyl-5α-androstane-3β,17β-diol

2α-(ヒドロキシメチル)-17-メチル-5α-アンドロスタン-3β,17β-ジオール
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： C21H36O3
Molecular formula furigana： C21-H36-O3
Molecular weight： 336.516
InChI： InChI=1S/C21H36O3/c1-19-11-13(12-22)18(23)10-14(19)4-5-15-16(19)6-8-20(2)17(15)7-9-21(20,3)24/h13-18,22-24H,4-12H2,1-3H3/t13-,14-,15+,16-,17-,18+,19-,20-,21-/m0/s1
InChI key： FJEQNAVGFPKKSD-KWHXHVTNSA-N
SMILES： C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)[C@H](CO)C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 2α-(ヒドロキシメチル)-17-メチル-5α-アンドロスタン-3β,17β-ジオール
  • (1S,3aS,3bR,5aS,7R,8S,9aS,9bS,11aS)-8-(ヒドロキシメチル)-1,9a,11a-トリメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1,7-ジオール
  • (1S,3aS,3bR,5aS,7R,8S,9aS,9bS,11aS)-8-(hydroxymethyl)-1,9a,11a-trimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-1,7-diol
Other name (1)：
  • 2α-(Hydroxymethyl)-17-methyl-5α-androstane-3β,17β-diol
KEGG COMPOUND： C14977
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