Compound Identification
SMILES
COC1CC(OC)(OC2=C1C=C(Cl)C=C2)C1=CC=CC=C1
InChIKey
InChIKey=AJBMTGGPSTWOGS-UHFFFAOYSA-N
Formula
C17H17ClO3
Mass
304.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 4-O-methylated flavonoids
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Subclass
O-methylated flavonoids
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
O-methylated flavonoids
Intermediate Tree Nodes
Not available
Direct Parent
4-O-methylated flavonoids
Alternative Parents
2-O-methylated flavonoids Flavans 1-benzopyrans Benzylethers Ketals Aryl chlorides Oxacyclic compounds Dialkyl ethers Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-methoxyflavonoid-skeleton - 4-methoxyflavonoid-skeleton - Flavan - Chromane - Benzopyran - 1-benzopyran - Benzylether - Ketal - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dialkyl ether - Organoheterocyclic compound - Oxacycle - Acetal - Ether - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C4 atom of the flavonoid backbone.
External Descriptors
Not available