Compound Identification
SMILES
COC1=C(C)C2=C(C(=O)C(=CO2)C2=CC(OC)=C(OC)C=C2)C(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O[C@@H]2OC(C)[C@H](O)[C@H](O)C2O)=C1
InChIKey
InChIKey=HBIBVIWVUMZFQY-DKWJMLPBSA-N
Formula
C31H38O15
Mass
650.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
- Subclass Isoflavonoid O-glycosides
-
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
3'-O-methylisoflavones 4'-O-methylisoflavones 7-O-methylisoflavones Isoflavones Phenolic glycosides O-glycosyl compounds Chromones Disaccharides Dimethoxybenzenes Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Oxanes Vinylogous esters Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Acetals Polyols Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavonoid o-glycoside - Isoflavonoid-5-o-glycoside - 3p-methoxyisoflavone - 4p-o-methylisoflavone - 7-o-methylisoflavone - Isoflavone - Phenolic glycoside - Chromone - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzopyran - O-dimethoxybenzene - Dimethoxybenzene - 1-benzopyran - Phenol ether - Anisole - Methoxybenzene - Phenoxy compound - Pyranone - Alkyl aryl ether - Pyran - Benzenoid - Oxane - Monocyclic benzene moiety - Vinylogous ester - Heteroaromatic compound - Secondary alcohol - Polyol - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Organic oxide - Primary alcohol - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - 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
LIPIDMAPS (LMPK12050358) : Isoflavonoids