CAS 13744-15-5: β-Cubebene

Description:β-Cubebene is a naturally occurring sesquiterpene hydrocarbon, primarily found in the essential oils of various plants, particularly in the cubeb pepper (Piper cubeba). It is characterized by its distinct aromatic properties, contributing to the fragrance profile of essential oils. The molecular formula of β-Cubebene is C15H24, indicating it consists of 15 carbon atoms and 24 hydrogen atoms. This compound is typically a colorless to pale yellow liquid with a characteristic spicy, woody scent. β-Cubebene is known for its potential applications in perfumery and flavoring, as well as its role in traditional medicine. Additionally, it exhibits various biological activities, including antimicrobial and anti-inflammatory properties, making it of interest in pharmacological research. Its structure features a bicyclic framework, which is common among sesquiterpenes, contributing to its stability and reactivity. Overall, β-Cubebene is a significant compound in both natural product chemistry and industrial applications.

Formula:C₁₅H₂₄

InChI:InChI=1S/C15H24/c1-9(2)12-6-5-11(4)15-8-7-10(3)13(15)14(12)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13-,14-,15+/m1/s1

InChI key:InChIKey=FSRZGYRCMPZNJF-KHMAMNHCSA-N

SMILES:C=C1CCC23C(C)CCC(C(C)C)C3C12

Synonyms:
(-)-β-Cubebene
(3aS,3bR,4S,7R,7aR)-Octahydro-7-methyl-3-methylene-4-(1-methylethyl)-1H-cyclopenta[1,3]cyclopropa[1,2]benzene
1H-Cyclopenta[1,3]cyclopropa[1,2]benzene, 2,3,3aα,3bα,4,5,6,7-octahydro-4α-isopropyl-7β-methyl-3-methylene-
1H-Cyclopenta[1,3]cyclopropa[1,2]benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, [3aS-(3aα,3bβ,4β,7α,7aS*)]-
beta-cubebene
1H-CYCLOPENTA[1,3]CYCLOPROPA[1)
1H-Cyclopenta[1,3]cyclopropa[1,2]benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, (3aS,3bR,4S,7R,7aR)-
(3aS,3bR,4S,7R,7aR)-7-methyl-3-methylidene-4-(propan-2-yl)octahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzene