Compound Identification
SMILES
COC1=CC=C(C=C1)C1=COC2=CC(O[C@@H]3OC(COC(=O)CC(O)=O)[C@@H](O)[C@H](O)C3O)=CC(O)=C2C1=O
InChIKey
InChIKey=VRCBYTZZZFFKEN-NXYYJASPSA-N
Formula
C25H24O13
Mass
532.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
4'-O-methylisoflavones Hydroxyisoflavonoids Isoflavones Phenolic glycosides Chromones O-glycosyl compounds Anisoles Methoxybenzenes Phenoxy compounds 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Alkyl aryl ethers Monosaccharides Oxanes Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Vinylogous acids Heteroaromatic compounds Secondary alcohols Carboxylic acid esters Polyols Acetals Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid-7-o-glycoside - Isoflavonoid o-glycoside - 4p-o-methylisoflavone - Isoflavone - Hydroxyisoflavonoid - Phenolic glycoside - O-glycosyl compound - Glycosyl compound - Chromone - 1-benzopyran - Benzopyran - Methoxybenzene - Phenol ether - Phenoxy compound - Anisole - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - 1,3-dicarbonyl compound - Monosaccharide - Oxane - Pyran - Vinylogous acid - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Polyol - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Carboxylic acid - Oxacycle - Acetal - Organic oxygen compound - Carbonyl group - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - 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
LIPIDMAPS (LMPK12050224) : Isoflavonoids