Chem
J-GLOBAL ID：200907004521259243   Nikkaji number：J38.590E

Caryophyllene oxide

カリオフィレンオキシド
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： C15H24O
Molecular formula furigana： C15-H24-O
Molecular weight： 220.356
InChI： InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1
InChI key： NVEQFIOZRFFVFW-RGCMKSIDSA-N
SMILES： C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC[C@H]1O2
Systematic name  (5)：
  • (1R,4R,6R,10S)-4,12,12-トリメチル-9-メチレン-5-オキサトリシクロ[8.2.0.04,6]ドデカン
  • (1R,5S,8R,11R)-4-メチレン-7,7,11-トリメチル-12-オキサトリシクロ[9.1.0.05,8]ドデカン
  • (1β,4R,5R,9α)-4,11,11-トリメチル-8-メチレン-4,5-エポキシビシクロ[7.2.0]ウンデカン
  • (1R,4R,6R,10S)-4,12,12-トリメチル-9-メチリデン-5-オキサトリシクロ[8.2.0.04,6]ドデカン
  • (1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane
Other name (12)：
  • カリオフィレンオキシド
  • Caryophyllene oxide
  • β-カリオフィレンオキシド
  • β-Caryophyllene oxide
  • (1R,4R,6R,10S)-4,12,12-Trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
Show all
CAS registry number： 1139-30-6
Regulation number (3)：
  • (4)-590
  • EINECS2145197
  • TSCA(1139-30-6)
KEGG COMPOUND： C16908
Application (1)：
essential oil
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