Compound Identification
SMILES
COC(=O)C1=C(C)C(=C(C=C1)C(C)C)S(C)(=O)=O
InChIKey
InChIKey=LXRCLYLBKKYWLH-UHFFFAOYSA-N
Formula
C13H18O4S
Mass
270.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Aromatic monoterpenoids
-
Subclass
Monoterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Aromatic monoterpenoids
Alternative Parents
Monocyclic monoterpenoids Benzoic acid esters Phenylpropanes Cumenes Benzenesulfonyl compounds Benzoyl derivatives Toluenes Sulfones Methyl esters Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Benzoate ester - Monocyclic monoterpenoid - Benzenesulfonyl group - Benzoic acid or derivatives - Cumene - Phenylpropane - Benzoyl - Toluene - Benzenoid - Monocyclic benzene moiety - Sulfonyl - Methyl ester - Sulfone - Carboxylic acid ester - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors
Not available