Compound Identification
SMILES
COC1=CC=C(C=C1)C1=C(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)C(=O)C2=CC=CC=C2O1
InChIKey
InChIKey=CXAPKJYBBQEZLT-NTCFOVGGSA-N
Formula
C22H22O9
Mass
430.409
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
Flavonoid glycosides
-
Level 5
Flavonoid O-glycosides
- Level 6 Flavonoid-3-O-glycosides
-
Level 5
Flavonoid O-glycosides
-
Subclass
Flavonoid glycosides
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavonoid glycosides
Intermediate Tree Nodes
Flavonoid O-glycosides
Direct Parent
Flavonoid-3-O-glycosides
Alternative Parents
4'-O-methylated flavonoids Flavones Hexoses Chromones O-glycosyl compounds Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyranones and derivatives Oxanes Heteroaromatic compounds Secondary alcohols Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonoid-3-o-glycoside - 4p-methoxyflavonoid-skeleton - Flavone - Hexose monosaccharide - Chromone - Glycosyl compound - O-glycosyl compound - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Pyranone - Alkyl aryl ether - Benzenoid - Oxane - Monosaccharide - Pyran - Monocyclic benzene moiety - Heteroaromatic compound - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Ether - Acetal - Primary alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.
External Descriptors
LIPIDMAPS (LMPK12111614) : Flavones and Flavonols