Compound Identification
SMILES
COC1=CC(OC)=C2C(=O)C(Br)C(OC2=C1)C1=CC(OC)=C(OC)C(OC)=C1
InChIKey
InChIKey=ALCMOTDPOQLVCO-UHFFFAOYSA-N
Formula
C20H21BrO7
Mass
453.285
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
3'-O-methylated flavonoids 4'-O-methylated flavonoids 5-O-methylated flavonoids Flavanones Chromones Phenoxy compounds Methoxybenzenes Aryl alkyl ketones Anisoles Alkyl aryl ethers Alpha-haloketones Oxacyclic compounds Alkyl bromides Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyflavonoid-skeleton - 4p-methoxyflavonoid-skeleton - 5-methoxyflavonoid-skeleton - 7-methoxyflavonoid-skeleton - Flavanone - Flavan - Chromone - Benzopyran - Chromane - 1-benzopyran - Phenoxy compound - Methoxybenzene - Aryl alkyl ketone - Anisole - Aryl ketone - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Organic oxygen compound - Organohalogen compound - Organobromide - Organooxygen compound - Alkyl halide - Alkyl bromide - Hydrocarbon derivative - Organic oxide - 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