Compound Identification
SMILES
COC(=O)[C@@H](NC(=O)O[C@H]1[C@@H](OC2=C(C=CC(OC)=C2)C1=O)C1=CC(=CC=C1)C(F)(F)F)C(C)C
InChIKey
InChIKey=PBDIAJYRAMOINO-SESVDKBCSA-N
Formula
C24H24F3NO7
Mass
495.451
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
Flavanonols Valine and derivatives Alpha amino acid esters Chromones Trifluoromethylbenzenes Anisoles Aryl alkyl ketones Alkyl aryl ethers Fatty acid esters Methyl esters Carbamate 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 - Flavanone - Flavanonol - Flavan - Alpha-amino acid ester - Valine or derivatives - Chromone - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Chromane - Benzopyran - 1-benzopyran - Anisole - Aryl alkyl ketone - Aryl ketone - Phenol ether - Alkyl aryl ether - Fatty acid ester - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Methyl ester - Carbamic acid ester - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Organofluoride - Organonitrogen 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