Compound Identification
SMILES
COC1=CC2=C(C=C1)C(=O)[C@@H](OC(=O)NCCOC1=CC=CC=C1)[C@@H](O2)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=HIAXDKAHTXGJGL-BJKOFHAPSA-N
Formula
C26H22F3NO6
Mass
501.458
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 7-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
7-O-methylated flavonoids
Alternative Parents
Flavanonols Chromones Trifluoromethylbenzenes Phenoxy compounds Aryl alkyl ketones Anisoles Alkyl aryl ethers Carbamate esters Oxacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Chromone - Chromane - Benzopyran - Trifluoromethylbenzene - 1-benzopyran - Anisole - Phenoxy compound - Phenol ether - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Carbamic acid ester - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organofluoride - Alkyl fluoride - Organonitrogen compound - Alkyl halide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.
External Descriptors
Not available