1alpha,3beta-Dihydroxy-17beta-(4-ethyl-4-hydroxyhexyloxymethyl)androsta-5,7-diene

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基本情報

標準SMILES: CCC(O)(CC)CCCOC[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)C[C@H](O)[C@]4(C)[C@H]3CC[C@]12C
InChIKey: UQDUNUCSIJCTKW-IOIKQUDLSA-N
分子式: C28H46O4
平均分子量: 446.7 g/mol
単同位体質量: 446.33960994

優先名称: 1alpha,3beta-Dihydroxy-17beta-(4-ethyl-4-hydroxyhexyloxymethyl)androsta-5,7-diene
IUPAC: (1S,3R,9S,10R,13S,14R,17S)-17-[(4-ethyl-4-hydroxyhexoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

SCHEMBL5996804UQDUNUCSIJCTKW-IOIKQUDLSA-N1alpha,3beta-dihydroxy-17beta-(4-ethyl-4-hydroxyhexyloxymethyl)androsta-5,7-diene

読み込み中…

標準SMILES: CCC(O)(CC)CCCOC[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)C[C@H](O)[C@]4(C)[C@H]3CC[C@]12C
InChIKey: UQDUNUCSIJCTKW-IOIKQUDLSA-N
分子式: C28H46O4
平均分子量: 446.7 g/mol
単同位体質量: 446.33960994

優先名称: 1alpha,3beta-Dihydroxy-17beta-(4-ethyl-4-hydroxyhexyloxymethyl)androsta-5,7-diene
IUPAC: (1S,3R,9S,10R,13S,14R,17S)-17-[(4-ethyl-4-hydroxyhexoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

SCHEMBL5996804UQDUNUCSIJCTKW-IOIKQUDLSA-N1alpha,3beta-dihydroxy-17beta-(4-ethyl-4-hydroxyhexyloxymethyl)androsta-5,7-diene

読み込み中…