Compound Identification
SMILES
COC1=CC=CC2=C1C(=O)C=C(O2)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=NPSCAQRYMMIRTK-UHFFFAOYSA-N
Formula
C17H11F3O3
Mass
320.267
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
Flavones Chromones Trifluoromethylbenzenes Anisoles Pyranones and derivatives Alkyl aryl ethers Vinylogous esters Heteroaromatic compounds Oxacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-methoxyflavonoid-skeleton - Flavone - Chromone - Trifluoromethylbenzene - Benzopyran - 1-benzopyran - Anisole - Phenol ether - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous ester - Ether - Organoheterocyclic compound - Oxacycle - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - 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