Compound Identification
SMILES
CC(C)C1=C(Br)C=C(C(C)=CC2C(C(O)=O)C2(C)C)C(F)=C1
InChIKey
InChIKey=RKBXKGUAWPHRBF-UHFFFAOYSA-N
Formula
C18H22BrFO2
Mass
369.274
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 Phenylpropenes Phenylpropanes Cumenes Styrenes Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Cyclopropanecarboxylic acids Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Bisabolane sesquiterpenoid - Sesquiterpenoid - P-cymene - Cumene - Phenylpropane - Phenylpropene - Styrene - Bromobenzene - Fluorobenzene - Halobenzene - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Cyclopropanecarboxylic acid - Cyclopropanecarboxylic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Carbonyl group - Organofluoride - Organohalogen compound - Organobromide - Organooxygen compound - Organic oxide - Organic oxygen 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