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(Q105183234)
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Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1R,4E,9S)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Caryophyllene,alpha + beta mixt.
1 reference
based on heuristic
inferred from SMILES
Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-
1 reference
based on heuristic
inferred from SMILES
(4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
1 reference
based on heuristic
inferred from SMILES
mass
204.187800768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,4Z,9R)-4,11,11-Trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(E)-2-epi-beta-caryophyllene
1 reference
based on heuristic
inferred from InChIKey
isocaryophyllene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(Z)-caryophyllene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Caryophyllene (z-)
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
caryophyllene
1 reference
based on heuristic
inferred from InChI
CTK1J1717
1 reference
based on heuristic
inferred from InChI
(+)-beta-caryophyllene
1 reference
based on heuristic
inferred from InChI
Bicyclo(7.2.0)undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄
0 references
canonical SMILES
C=C1CCC=C(C)CCC2C1CC2(C)C
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isomeric SMILES
C=C1CCC=C(C)CC[C@@H]2[C@@H]1CC2(C)C
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found in taxon
Brickellia veronicaefolia
1 reference
stated in
Qualitative and quantitative analysis of the active components of the essential oil from Brickellia veronicaefolia by nuclear magnetic resonance spectroscopy.
Copaifera
1 reference
stated in
Terpenes from Copaifera demonstrated in vitro antiparasitic and synergic activity.
Identifiers
InChI
InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/t13-,14-/m1/s1
0 references
InChIKey
NPNUFJAVOOONJE-ZIAGYGMSSA-N
0 references
PubChem CID
6887
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NPNUFJAVOOONJE-ZIAGYGMSSA-N
UniChem compound ID
27124948
1 reference
stated in
UniChem
Probes And Drugs ID
PD040719
0 references
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