Chem
J-GLOBAL ID：201507040183750916   Nikkaji number：J3.343.480D

8-Methylene-5β-(benzyloxy)-4aα-methyl-2-oxo-2,3,4,4a,4bβ,5,6,7,8,8a,9,10-dodecahydrophenanthrene-8aα-carbonitrile

8-メチレン-5β-(ベンジルオキシ)-4aα-メチル-2-オキソ-2,3,4,4a,4bβ,5,6,7,8,8a,9,10-ドデカヒドロフェナントレン-8aα-カルボニトリル
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： C24H27NO2
Molecular formula furigana： C24-H27-N-O2
Molecular weight： 361.485
InChI： InChI=1S/C24H27NO2/c1-17-8-9-21(27-15-18-6-4-3-5-7-18)22-23(2)12-11-20(26)14-19(23)10-13-24(17,22)16-25/h3-7,14,21-22H,1,8-13,15H2,2H3/t21-,22-,23+,24-/m0/s1
InChI key： DNAPROZRPRAXEI-XQUALCHDSA-N
SMILES： C[C@@]12CCC(=O)C=C1CC[C@@]1(C#N)[C@H]2[C@H](CCC1=C)OCc1ccccc1
Systematic name  (3)：
  • 8-メチレン-5β-(ベンジルオキシ)-4aα-メチル-2-オキソ-2,3,4,4a,4bβ,5,6,7,8,8a,9,10-ドデカヒドロフェナントレン-8aα-カルボニトリル
  • (4aS,4bS,5S,8aR)-5-(ベンジルオキシ)-4a-メチル-8-メチリデン-2-オキソ-2,3,4,4a,4b,5,6,7,8,8a,9,10-ドデカヒドロフェナントレン-8a-カルボニトリル
  • (4aS,4bS,5S,8aR)-5-(benzyloxy)-4a-methyl-8-methylidene-2-oxo-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydrophenanthrene-8a-carbonitrile
Other name (1)：
  • 8-Methylene-5β-(benzyloxy)-4aα-methyl-2-oxo-2,3,4,4a,4bβ,5,6,7,8,8a,9,10-dodecahydrophenanthrene-8aα-carbonitrile
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