Compound Identification
SMILES
CCCCCCC[C@H]1CC[C@@H](CC1)[C@H](C)C1=CC=C(C=C1)C1=CC=C(OC(=O)[C@@H](F)[C@H](C)CC)C=C1
InChIKey
InChIKey=HNWBGUNSCWZMKM-OFGVZPETSA-N
Formula
C33H47FO2
Mass
494.735
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesquiterpenoids
-
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
Biphenyls and derivatives Phenol esters Aromatic monoterpenoids Phenoxy compounds Fatty acid esters Alpha-halocarboxylic acid derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Sesquiterpenoid - Bisabolane sesquiterpenoid - Biphenyl - P-cymene - Phenol ester - Phenoxy compound - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alkyl fluoride - Organic oxygen compound - Organooxygen compound - Alkyl halide - 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