Compound Identification
SMILES
CCOC(=O)C(\F)=C(/CC)C1=C(OCC)C(Br)=C2C(=C1)C(=CCC2(C)C)C(C)CC
InChIKey
InChIKey=ILNOYWWMFBMQAQ-JWGURIENSA-N
Formula
C25H34BrFO3
Mass
481.446
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
Cinnamic acid esters Coumaric acids and derivatives Naphthalenes Phenol ethers Alkyl aryl ethers Fatty acid esters Aryl bromides Alpha-halocarboxylic acid derivatives Enoate esters Vinyl fluorides Monocarboxylic acids and derivatives Fluoroalkenes Organic oxides Carbonyl compounds Organofluorides Hydrocarbon derivatives Organobromides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cadinane sesquiterpenoid - Sesquiterpenoid - Coumaric acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - Naphthalene - Phenol ether - Alkyl aryl ether - Fatty acid ester - Fatty acyl - Aryl bromide - Aryl halide - Benzenoid - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Vinyl fluoride - Vinyl halide - Carboxylic acid derivative - Haloalkene - Fluoroalkene - Organohalogen compound - Organofluoride - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organobromide - Aromatic homopolycyclic 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