Compound Identification
SMILES
COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1[C@@H](OC2=C(C=CC(OC)=C2)C1=O)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=QKBGJWFNIFEAPC-GVXSCFBNSA-N
Formula
C28H24F3NO7
Mass
543.495
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
-
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
Phenylalanine and derivatives Flavanonols Alpha amino acid esters Chromones Trifluoromethylbenzenes Amphetamines and derivatives Anisoles Aryl alkyl ketones Fatty acid esters Alkyl aryl ethers Carbamate esters Methyl esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Phenylalanine or derivatives - Flavanonol - Flavanone - Flavan - Alpha-amino acid ester - Chromone - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Amphetamine or derivatives - Chromane - 1-benzopyran - Benzopyran - Anisole - Aryl alkyl ketone - Aryl ketone - Phenol ether - Fatty acid ester - Alkyl aryl ether - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Methyl ester - Carbamic acid ester - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Alkyl fluoride - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Alkyl halide - Organonitrogen compound - Organooxygen compound - Organic oxide - 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