Compound Identification
SMILES
COC1=CC=CC2=C1C1=C(C=C(C=C1)C1=CC=CC=C1C(N)=O)C(O2)C1=CC(F)=CC=C1
InChIKey
InChIKey=XJFABAUFBSJHDC-UHFFFAOYSA-N
Formula
C27H20FNO3
Mass
425.459
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 5-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
5-O-methylated flavonoids
Alternative Parents
Dibenzopyrans 2-benzopyrans Benzamides Benzoyl derivatives Anisoles Fluorobenzenes Alkyl aryl ethers Aryl fluorides Primary carboxylic acid amides Oxacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-methoxyflavonoid-skeleton - Dibenzopyran - Benzopyran - 1-benzopyran - 2-benzopyran - Benzamide - Benzoic acid or derivatives - Anisole - Benzoyl - Alkyl aryl ether - Fluorobenzene - Halobenzene - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Primary carboxylic acid amide - Carboxamide group - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organonitrogen compound - Organofluoride - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 5-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C5 atom of the flavonoid backbone.
External Descriptors
Not available