Compound Identification
SMILES
COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1[C@@H](OC2=C(C=C(OC)C=C2)C1=O)C1=CC(Br)=C(OC)C=C1
InChIKey
InChIKey=WRKXYSBCBNKMFO-OUIFVKKZSA-N
Formula
C28H26BrNO8
Mass
584.419
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 Phenylalanine and derivatives Flavanonols Alpha amino acid esters Chromones Amphetamines and derivatives Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Fatty acid esters Bromobenzenes Alkyl aryl ethers Aryl bromides Carbamate esters Methyl esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organobromides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-methoxyflavonoid-skeleton - 6-methoxyflavonoid-skeleton - Phenylalanine or derivatives - Flavanonol - Flavanone - Flavan - Alpha-amino acid ester - Chromone - Alpha-amino acid or derivatives - Amphetamine or derivatives - 1-benzopyran - Benzopyran - Chromane - Methoxybenzene - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Phenol ether - Anisole - Alkyl aryl ether - Bromobenzene - Fatty acid ester - Halobenzene - Fatty acyl - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Methyl ester - Carbamic acid ester - Carboxylic acid ester - Ketone - Ether - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - 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