Compound Identification
SMILES
COC1=CC=C(C=C1)C1=COC2=CC(OC3OC(COC(=O)CC([O-])=O)C(O)C(O)C3O)=C(OC)C=C2C1=O
InChIKey
InChIKey=HOWDEROVXAADRI-UHFFFAOYSA-M
Formula
C26H25O13
Mass
545.474
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
4'-O-methylisoflavones Isoflavones Phenolic glycosides Chromones O-glycosyl compounds Phenoxy compounds Anisoles Methoxybenzenes Pyranones and derivatives Alkyl aryl ethers 1,3-dicarbonyl compounds Oxanes Monosaccharides Dicarboxylic acids and derivatives Heteroaromatic compounds Secondary alcohols Carboxylic acid esters Carboxylic acid salts Acetals Polyols Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid o-glycoside - Isoflavonoid-7-o-glycoside - 4p-o-methylisoflavone - Isoflavone - Phenolic glycoside - O-glycosyl compound - Glycosyl compound - Chromone - 1-benzopyran - Benzopyran - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Pyranone - Alkyl aryl ether - Pyran - Monocyclic benzene moiety - Monosaccharide - Oxane - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid salt - Secondary alcohol - Carboxylic acid - Acetal - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Ether - Polyol - Alcohol - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic anion - 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
META CYC (CPD-10081) : an isoflavone