Compound Identification
SMILES
[Na].COC1=CC2=C(C=C1)C(=O)C(OS(O)(=O)=O)=C(O2)C1=CC=CC=C1
InChIKey
InChIKey=HMEYSKKEONRDPM-UHFFFAOYSA-N
Formula
C16H12NaO7S
Mass
371.31
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
Flavones Chromones Arylsulfates Anisoles Pyranones and derivatives Alkyl aryl ethers Sulfuric acid monoesters Benzene and substituted derivatives Heteroaromatic compounds Oxacyclic compounds Organic alkali metal salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-methoxyflavonoid-skeleton - Flavone - Chromone - Arylsulfate - Benzopyran - 1-benzopyran - Anisole - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Pyran - Sulfuric acid monoester - Sulfate-ester - Benzenoid - Sulfuric acid ester - Organic sulfuric acid or derivatives - Heteroaromatic compound - Organic alkali metal salt - Ether - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - 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