Compound Identification
SMILES
CC1=CC2=C(C(O)=C1)C(O)(C(C(=O)O2)C1=CC=CC=C1)C(F)(F)F
InChIKey
InChIKey=IAGFUADIRHESIX-UHFFFAOYSA-N
Formula
C17H13F3O4
Mass
338.282
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Hydroxyisoflavonoids
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Hydroxyisoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxyisoflavonoids
Alternative Parents
3-arylcoumarin flavonoids Isoflavans 3,4-dihydrocoumarins 1-benzopyrans 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Benzene and substituted derivatives Tertiary alcohols Lactones Carboxylic acid esters Fluorohydrins Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-arylcoumarin flavonoid - Hydroxyisoflavonoid - Isoflavan - 3,4-dihydrocoumarin - Benzopyran - 1-benzopyran - Chromane - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Tertiary alcohol - Halohydrin - Fluorohydrin - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Organic oxygen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxyisoflavonoids. These are organic compounds containing an isoflavonoid skeleton carrying one or more hydroxyl groups.
External Descriptors
Not available