Chem
J-GLOBAL ID：200907039951462717   Nikkaji number：J627.478A

2-Desoxystemodinone

2-デスオキシステモジノン
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： C20H34O
Molecular formula furigana： C20-H34-O
Molecular weight： 290.491
InChI： InChI=1S/C20H34O/c1-17(2)8-5-9-18(3)16(17)7-6-14-12-15-13-20(14,18)11-10-19(15,4)21/h14-16,21H,5-13H2,1-4H3/t14-,15-,16-,18-,19-,20+/m0/s1
InChI key： ODCPNBCPLWJVQI-WKSOIMLMSA-N
SMILES： CC1(C)CCC[C@@]2(C)[C@H]1CC[C@H]1C[C@H]3C[C@@]21CC[C@]3(C)O
Systematic name  (3)：
  • (8S,13S)-9,15:14β,20-ジシクロラブダン-13-オール
  • (1R,2S,7S,10S,12S,13S)-2,6,6,13-テトラメチルテトラシクロ[10.3.1.01,10.02,7]ヘキサデカン-13-オール
  • (1R,2S,7S,10S,12S,13S)-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-ol
Other name (3)：
  • 2-デスオキシステモジノン
  • 2-Desoxystemodinone
  • (8S,13S)-9,15:14β,20-Dicyclolabdan-13-ol
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