Compound Identification
SMILES
COC1=C(OC)C2=C(C(O)=C1)C(=O)C(OC)=C(O2)C1=C(O)C(Br)=CC=C1
InChIKey
InChIKey=PRRZKYZEPCKTFD-UHFFFAOYSA-N
Formula
C18H15BrO7
Mass
423.215
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
O-methylated flavonoids
- Level 5 8-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
8-O-methylated flavonoids
Alternative Parents
3-O-methylated flavonoids 7-O-methylated flavonoids 5-hydroxyflavonoids Flavones 3-methoxychromones Anisoles O-bromophenols Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Pyranones and derivatives 1-hydroxy-4-unsubstituted benzenoids Aryl bromides Heteroaromatic compounds Vinylogous acids Oxacyclic compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-methoxyflavonoid-skeleton - 7-methoxyflavonoid-skeleton - 8-methoxyflavonoid-skeleton - Flavone - 5-hydroxyflavonoid - Hydroxyflavonoid - 3-methoxychromone - Chromone - Benzopyran - 1-benzopyran - 2-halophenol - 2-bromophenol - Anisole - Phenol ether - Phenol - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Pyranone - Aryl halide - Monocyclic benzene moiety - Pyran - Aryl bromide - Benzenoid - Heteroaromatic compound - Vinylogous acid - Organoheterocyclic compound - Oxacycle - Ether - Organobromide - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 8-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C8 atom of the flavonoid backbone.
External Descriptors
Not available