Compound Identification
SMILES
COC1=CC=CC(=C1)[C@@H]1OC2=C(C=C(Br)C=C2)C(=O)[C@H]1OC(=O)NC1=CC=C(OC(F)F)C=C1
InChIKey
InChIKey=FJWPZULNJQWJPR-FCHUYYIVSA-N
Formula
C24H18BrF2NO6
Mass
534.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 3'-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
3'-O-methylated flavonoids
Alternative Parents
Flavanonols Phenylcarbamic acid esters Chromones Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Alkyl aryl ethers Aryl bromides Carbamate esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Phenylcarbamic acid ester - Chromone - Chromane - Benzopyran - 1-benzopyran - Anisole - Phenoxy compound - Methoxybenzene - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Organic nitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organohalogen compound - Organobromide - Alkyl halide - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C3' atom of the flavonoid backbone.
External Descriptors
Not available