Chem
J-GLOBAL ID:200907000109210986   Nikkaji number:J577.787I

[(1,4aβ-Dimethyl-6-methoxy-1,2,3,4,4a,9,10,10aα-octahydrophenanthrene)-1α,7-diyl]dimethanol

[(1,4aβ-ジメチル-6-メトキシ-1,2,3,4,4a,9,10,10aα-オクタヒドロフェナントレン)-1α,7-ジイル]ジメタノール
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: C19H28O3
Molecular formula furigana: C19-H28-O3
Molecular weight: 304.430
InChI: InChI=1S/C19H28O3/c1-18(12-21)7-4-8-19(2)15-10-16(22-3)14(11-20)9-13(15)5-6-17(18)19/h9-10,17,20-21H,4-8,11-12H2,1-3H3/t17-,18-,19+/m0/s1
InChI key: AXPUHVPSXZMXCG-GBESFXJTSA-N
SMILES: COc1cc2c(CC[C@H]3[C@](C)(CO)CCC[C@]23C)cc1CO
Systematic name  (3):
  • [(1,4aβ-ジメチル-6-メトキシ-1,2,3,4,4a,9,10,10aα-オクタヒドロフェナントレン)-1α,7-ジイル]ジメタノール
  • [(4bS,8R,8aR)-8-(ヒドロキシメチル)-3-メトキシ-4b,8-ジメチル-4b,5,6,7,8,8a,9,10-オクタヒドロフェナントレン-2-イル]メタノール
  • [(4bS,8R,8aR)-8-(hydroxymethyl)-3-methoxy-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthren-2-yl]methanol
Other name (1):
  • [(1,4aβ-Dimethyl-6-methoxy-1,2,3,4,4a,9,10,10aα-octahydrophenanthrene)-1α,7-diyl]dimethanol
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