Chem
J-GLOBAL ID：200907056106928229   Nikkaji number：J942.904B

(1aS)-1a,1bα,2,3,3aβ,4,5,6,7b,8,9,9aβ-Dodecahydro-1aβ,5,7bβ-trimethyl-1H-cyclopropa[a]phenanthrene-5β-acetaldehyde

(1aS)-1a,1bα,2,3,3aβ,4,5,6,7b,8,9,9aβ-ドデカヒドロ-1aβ,5,7bβ-トリメチル-1H-シクロプロパ[a]フェナントレン-5β-アセトアルデヒド
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： C20H30O
Molecular formula furigana： C20-H30-O
Molecular weight： 286.459
InChI： InChI=1S/C20H30O/c1-18(10-11-21)8-7-16-14(12-18)4-5-17-19(16,2)9-6-15-13-20(15,17)3/h7,11,14-15,17H,4-6,8-10,12-13H2,1-3H3/t14-,15-,17+,18-,19+,20+/m1/s1
InChI key： BCKQSEXULHMIJG-ZPNQOMQUSA-N
SMILES： C[C@]12C[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2C[C@@](C)(CC=O)CC=C12
Systematic name  (3)：
  • (1aS)-1a,1bα,2,3,3aβ,4,5,6,7b,8,9,9aβ-ドデカヒドロ-1aβ,5,7bβ-トリメチル-1H-シクロプロパ[a]フェナントレン-5β-アセトアルデヒド
  • 2-[(1aS,1bR,3aR,5S,7bR,9aR)-1a,5,7b-トリメチル-1H,1aH,1bH,2H,3H,3aH,4H,5H,6H,7bH,8H,9H,9aH-シクロプロパ[a]フェナントレン-5-イル]アセトアルデヒド
  • 2-[(1aS,1bR,3aR,5S,7bR,9aR)-1a,5,7b-trimethyl-1H,1aH,1bH,2H,3H,3aH,4H,5H,6H,7bH,8H,9H,9aH-cyclopropa[a]phenanthren-5-yl]acetaldehyde
Other name (1)：
  • (1aS)-1a,1bα,2,3,3aβ,4,5,6,7b,8,9,9aβ-Dodecahydro-1aβ,5,7bβ-trimethyl-1H-cyclopropa[a]phenanthrene-5β-acetaldehyde
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