Compound Identification
SMILES
CC1=CC(N2CCCS2(=O)=O)=C2OC(=C(O)C(=O)C2=C1)C1=CC(Cl)=C(O)C=C1
InChIKey
InChIKey=QKUXZFIUKOCULS-UHFFFAOYSA-N
Formula
C19H16ClNO6S
Mass
421.85
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
3-hydroxyflavonoids 4'-hydroxyflavonoids Chromones Sulfanilides O-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Chlorobenzenes Gamma sultams Aryl chlorides Organosulfonamides Organic sulfonamides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-hydroxyflavone - 3-hydroxyflavonoid - 4'-hydroxyflavonoid - Hydroxyflavonoid - Chromone - Benzopyran - Sulfanilide - 1-benzopyran - 2-halophenol - 2-chlorophenol - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Gamma-sultam - Halobenzene - Phenol - Pyranone - Pyran - Monocyclic benzene moiety - Aryl halide - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Aryl chloride - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Oxacycle - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - 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