Compound Identification
SMILES
COC(=O)[C@H](COC(C)(C)C)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=CYJIQMMKGBWRIK-YUXAGFNASA-N
Formula
C26H28F3NO8
Mass
539.504
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 Alpha amino acid esters Chromones Trifluoromethylbenzenes Anisoles Aryl alkyl ketones Alkyl aryl ethers Methyl esters Carbamate esters Dialkyl ethers Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organofluorides Organonitrogen compounds Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Alpha-amino acid ester - Chromone - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Chromane - Benzopyran - 1-benzopyran - Anisole - Aryl alkyl ketone - Aryl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Methyl ester - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Organofluoride - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Organohalogen 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