Compound Identification
SMILES
COC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O1)C(=C(OS(O)(=O)=O)C=C2O)C(C)(C)C=C
InChIKey
InChIKey=RFTMSRADZWALLJ-UHFFFAOYSA-N
Formula
C21H20O9S
Mass
448.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavones
Intermediate Tree Nodes
Not available
Direct Parent
Flavonols
Alternative Parents
4'-O-methylated flavonoids 3-hydroxyflavonoids 5-hydroxyflavonoids Chromones Arylsulfates Phenoxy compounds Methoxybenzenes Anisoles 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Alkyl aryl ethers Sulfuric acid monoesters Vinylogous acids Heteroaromatic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-methoxyflavonoid-skeleton - 3-hydroxyflavone - 3-hydroxyflavonoid - 5-hydroxyflavonoid - Hydroxyflavonoid - Chromone - Benzopyran - Arylsulfate - 1-benzopyran - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Sulfate-ester - Sulfuric acid monoester - Pyran - Benzenoid - Sulfuric acid ester - Monocyclic benzene moiety - Vinylogous acid - Organic sulfuric acid or derivatives - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Ether - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonols. These are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position.
External Descriptors
Not available