Chem
J-GLOBAL ID：200907096954729785   Nikkaji number：J16.239F

Sesquicarene

セスキカレン
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： C15H24
Molecular formula furigana： C15-H24
Molecular weight： 204.357
InChI： InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)10-14(13)15/h6,10,13-14H,5,7-9H2,1-4H3/t13-,14+,15+/m0/s1
InChI key： MZOWOHKNFKJFFD-RRFJBIMHSA-N
SMILES： CC(=CCC[C@]1(C)[C@H]2CCC(=C[C@@H]12)C)C
Systematic name  (5)：
  • (1R,6β)-3,7-ジメチル-7β-(4-メチル-3-ペンテニル)ビシクロ[4.1.0]ヘプタ-2-エン
  • (1β,6β)-3,7-ジメチル-7β-(4-メチル-3-ペンテニル)ビシクロ[4.1.0]ヘプタ-2-エン
  • (1R,6S,7R)-3,7-ジメチル-7-(4-メチル-3-ペンテニル)ビシクロ[4.1.0]ヘプタ-2-エン
  • (1R,6S,7R)-3,7-ジメチル-7-(4-メチルペンタ-3-エン-1-イル)ビシクロ[4.1.0]ヘプタ-2-エン
  • (1R,6S,7R)-3,7-dimethyl-7-(4-methylpent-3-en-1-yl)bicyclo[4.1.0]hept-2-ene
Other name (5)：
  • セスキカレン
  • Sesquicarene
  • (1R,6β)-3,7-Dimethyl-7β-(4-methyl-3-pentenyl)bicyclo[4.1.0]hept-2-ene
  • (1β,6β)-3,7-Dimethyl-7β-(4-methyl-3-pentenyl)bicyclo[4.1.0]hepta-2-ene
  • (1R,6S,7R)-3,7-Dimethyl-7-(4-methyl-3-pentenyl)bicyclo[4.1.0]hepta-2-ene
CAS registry number： 20479-23-6
KEGG COMPOUND： C17065
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