Compound Identification
SMILES
CCCCCCCC1CCC(CC1)C(C)C1CCC(CC1)C(C)C1=CC(F)=C(C=C1)C#N
InChIKey
InChIKey=SXWPCHXXQDCGFQ-UHFFFAOYSA-N
Formula
C30H46FN
Mass
439.703
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesquiterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesquiterpenoids
Alternative Parents
Aromatic monoterpenoids Benzonitriles Fluorobenzenes Aryl fluorides Nitriles Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Bisabolane sesquiterpenoid - Sesquiterpenoid - P-cymene - Benzonitrile - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carbonitrile - Nitrile - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.
External Descriptors
Not available