Compound Identification
SMILES
COC1=CC2=C(O[C@@H]([C@@H](OC(=O)NCC3=CC=CO3)C2=O)C2=CC(Br)=C(OC)C=C2)C=C1
InChIKey
InChIKey=GWYGGPBPFZTGLR-YADHBBJMSA-N
Formula
C23H20BrNO7
Mass
502.317
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 6-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
6-O-methylated flavonoids
Alternative Parents
4'-O-methylated flavonoids Flavanonols Chromones Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Alkyl aryl ethers Bromobenzenes Aryl bromides Heteroaromatic compounds Carbamate esters Furans Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-methoxyflavonoid-skeleton - 6-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Chromone - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Aryl ketone - Aryl alkyl ketone - Bromobenzene - Alkyl aryl ether - Halobenzene - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Carbamic acid ester - Ketone - Oxacycle - Ether - Organoheterocyclic compound - Organohalogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone.
External Descriptors
Not available