Compound Identification
SMILES
ClC1=CC(\C=C2/COC3=CC=CC=C3C2=O)=CC2=C1OCCO2
InChIKey
InChIKey=QCUDCEXXGKNYEC-KPKJPENVSA-N
Formula
C18H13ClO4
Mass
328.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Homoisoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Homoisoflavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Homoisoflavonoids
Alternative Parents
Chromones Benzo-1,4-dioxanes Aryl ketones Alkyl aryl ethers Para dioxins Benzenoids Aryl chlorides Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Homoisoflavonoid - Chromone - Benzo-1,4-dioxane - Benzodioxane - Chromane - Benzopyran - 1-benzopyran - Aryl ketone - Alkyl aryl ether - Para-dioxin - Aryl halide - Aryl chloride - Benzenoid - Ketone - Ether - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as homoisoflavonoids. These are naturally occurring oxygen heterocycles with a structure based on a 16-carbon skeleton including a chromanone, chromone or chromane system with a benzyl group at position C-3.
External Descriptors
Not available