Compound Identification
SMILES
COC1=CC=C(C=C1)C1=C\C(=N/NC2=NC=NC3=CC=CC=C23)C2=CC(Cl)=C(C)C=C2O1
InChIKey
InChIKey=JOXWPHOIOUZVDY-QUPMIFSKSA-N
Formula
C25H19ClN4O2
Mass
442.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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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
Quinazolinamines 1-benzopyrans Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Imidolactams Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrazones Hydrocarbon derivatives Organopnictogen compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-methoxyflavonoid-skeleton - Quinazolinamine - Diazanaphthalene - Quinazoline - 1-benzopyran - Benzopyran - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Aryl chloride - Imidolactam - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Hydrazone - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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