Compound Identification
SMILES
OC1=C(Cl)C=C2C(=O)C(=COC2=C1)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=DNMCKPVXZRNCPE-UHFFFAOYSA-N
Formula
C17H11ClO5
Mass
330.72
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
Hydroxyisoflavonoids Chromones Benzo-1,4-dioxanes Halophenols Pyranones and derivatives Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Para dioxins Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxyisoflavonoid - Isoflavone - Chromone - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - 1-benzopyran - 2-halophenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Pyranone - Aryl chloride - Aryl halide - Benzenoid - Para-dioxin - Pyran - Heteroaromatic compound - Organoheterocyclic compound - Ether - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxide - 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