Chem
J-GLOBAL ID：200907094621097576   Nikkaji number：J13.551H

β-Vetivone

β-ベチボン
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： C15H22O
Molecular formula furigana： C15-H22-O
Molecular weight： 218.340
InChI： InChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12H,5-6,8-9H2,1-4H3/t12-,15+/m1/s1
InChI key： ISLOGSAEQNKPGG-DOMZBBRYSA-N
SMILES： C[C@@H]1CC(=O)C=C(C)[C@]21CCC(=C(C)C)C2
Systematic name  (3)：
  • (5R,10R)-6,10-ジメチル-2-(1-メチルエチリデン)スピロ[4.5]デカ-6-エン-8-オン
  • (5R,10R)-6,10-ジメチル-2-(プロパン-2-イリデン)スピロ[4.5]デカ-6-エン-8-オン
  • (5R,10R)-6,10-dimethyl-2-(propan-2-ylidene)spiro[4.5]dec-6-en-8-one
Other name (5)：
  • β-ベチボン
  • β-Vetivone
  • (5R,10R)-6,10-Dimethyl-2-(1-methylethylidene)spiro[4.5]dec-6-en-8-one
  • (-)-β-ベチボン
  • (-)-β-Vetivone
CAS registry number： 18444-79-6
Regulation number (1)：
  • TSCA(18444-79-6)
KEGG COMPOUND： C09745
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