Compound Identification
SMILES
CS(=O)C1=CC=C(C=C1)C1=C(C(=O)C2=C(O1)C=C(F)C=C2)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=ALAABWRQOGQFFY-UHFFFAOYSA-N
Formula
C22H13Cl2FO3S
Mass
447.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
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Subclass
Isoflav-2-enes
- Level 5 Isoflavones
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Subclass
Isoflav-2-enes
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-2-enes
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavones
Alternative Parents
Flavones Chromones Phenyl sulfoxides Dichlorobenzenes Pyranones and derivatives Aryl chlorides Aryl fluorides Heteroaromatic compounds Sulfoxides Oxacyclic compounds Sulfinyl compounds Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavone - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Phenyl sulfoxide - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Pyranone - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Sulfoxide - Organoheterocyclic compound - Oxacycle - Sulfinyl compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.
External Descriptors
Not available