Compound Identification
SMILES
COCO[C@@H]1[C@H](CCC2=CC=CC=C2)OC(=O)C=C1OC
InChIKey
InChIKey=GMXCAPVHCKCBJJ-XJKSGUPXSA-N
Formula
C16H20O5
Mass
292.331
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Kavalactones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Kavalactones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Kavalactones
Alternative Parents
Dihydropyranones Benzene and substituted derivatives Vinylogous esters Enoate esters Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Kavalactone - Dihydropyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Enoate ester - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactone - Monocarboxylic acid or derivatives - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as kavalactones. These are lactones, which is structurally characterized by a benzene ring and a pyranone moiety, linked to each other to form a 4-methoxy-6-(2-phenylethyl)-2H-pyran-2-one skeleton.
External Descriptors
Not available