Compound Identification
SMILES
COC1=CC2=C(C=C1)C(=O)[C@@H](OC(=O)NC1=CC(Br)=C(C)C=C1)[C@@H](O2)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=VOQHCDRULBVSJW-XZOQPEGZSA-N
Formula
C25H19BrF3NO5
Mass
550.328
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 Phenylcarbamic acid esters Chromones Trifluoromethylbenzenes Anisoles Aryl alkyl ketones Toluenes Alkyl aryl ethers Bromobenzenes Aryl bromides Carbamate esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Phenylcarbamic acid ester - Chromone - Chromane - Trifluoromethylbenzene - Benzopyran - 1-benzopyran - Anisole - Aryl alkyl ketone - Phenol ether - Aryl ketone - Toluene - Bromobenzene - Halobenzene - Alkyl aryl ether - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Ketone - Oxacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Carbonyl group - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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