Compound Identification
SMILES
CC(=O)OC1=CC=CC(=C1)C1=CC2=C(OC1)C(C)=C(OC(C)=O)C=C2
InChIKey
InChIKey=JULJSBKKPPJBCQ-UHFFFAOYSA-N
Formula
C20H18O5
Mass
338.359
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Isoflav-3-enes
-
Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-3-enes
Intermediate Tree Nodes
Not available
Direct Parent
Isoflav-3-enes
Alternative Parents
Phenol esters 1-benzopyrans Phenoxy compounds Alkyl aryl ethers Dicarboxylic acids and derivatives Carboxylic acid esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflav-3-ene skeleton - 1-benzopyran - Phenol ester - Benzopyran - Phenoxy compound - Alkyl aryl ether - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflav-3-enes. These are flavonoids with a structure based on the 3-phenylchromene skeleton, with a double bond between the C3 and C4 carbon atoms of the chromene moiety.
External Descriptors
Not available