Compound Identification
SMILES
OCC1OC(OC2=CC3=C(C=C2)C(=O)C(=CO3)C2=CC=C(F)C=C2)C(O)C(=O)C1O
InChIKey
InChIKey=FNJCFCHAQOXFCJ-UHFFFAOYSA-N
Formula
C21H17FO8
Mass
416.357
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Isoflavonoid O-glycosides
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflavonoid O-glycosides
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavonoid O-glycosides
Alternative Parents
Isoflavones Chromones Pyranones and derivatives Fluorobenzenes Aryl fluorides Oxanes Monosaccharides Heteroaromatic compounds Secondary alcohols Cyclic ketones Oxacyclic compounds Acetals Organofluorides Aldehydes Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid o-glycoside - Isoflavonoid-7-o-glycoside - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Halobenzene - Fluorobenzene - Pyranone - Aryl fluoride - Aryl halide - Monosaccharide - Benzenoid - Oxane - Monocyclic benzene moiety - Pyran - Heteroaromatic compound - Ketone - Cyclic ketone - Secondary alcohol - Organoheterocyclic compound - Acetal - Oxacycle - Organic oxygen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Aldehyde - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavonoid o-glycosides. These are o-glycosylated derivatives of isoflavonoids, which are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available