Compound Identification
SMILES
CCC1=CC=C(C=C1)C(\C(Br)=C(/Br)C(O)=O)C1=CC=C(CC)C=C1
InChIKey
InChIKey=VJHYTULURZUAAF-VHEBQXMUSA-N
Formula
C20H20Br2O2
Mass
452.186
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
Diphenylmethanes Aromatic monoterpenoids Vinylogous halides Alpha-halocarboxylic acids Vinyl bromides Monocarboxylic acids and derivatives Carboxylic acids Bromoalkenes Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Sesquiterpenoid - Bisabolane sesquiterpenoid - Diphenylmethane - P-cymene - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Vinylogous halide - Bromoalkene - Carboxylic acid derivative - Carboxylic acid - Haloalkene - Monocarboxylic acid or derivatives - Vinyl halide - Vinyl bromide - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organooxygen compound - Carbonyl group - Organic oxide - 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