Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)OC2[C@H](OCC3O[C@@H](OC4=C(OC5=CC(O)=C(OC)C(O)=C5C4=O)C4=CC(O)=C(O)C=C4)C(O[C@@H]4OCC(O)(CO)[C@@H]4O)[C@@H](O)[C@@H]3O)OC(CO)[C@@H](O)[C@@H]2O)=C1
InChIKey
InChIKey=VSMDAOFJZBLZOB-JPWWWHFLSA-N
Formula
C43H48O25
Mass
964.832
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavonoid glycosides
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Level 5
Flavonoid O-glycosides
- Level 6 Flavonoid-3-O-glycosides
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Level 5
Flavonoid O-glycosides
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Subclass
Flavonoid glycosides
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Class
Flavonoids
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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
Oligosaccharides 6-O-methylated flavonoids Flavones 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Coumaric acids and derivatives Cinnamic acid esters Chromones O-glycosyl compounds Methoxyphenols Styrenes Catechols Methoxybenzenes Phenoxy compounds Anisoles 1-hydroxy-4-unsubstituted benzenoids Fatty acid esters 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Alkyl aryl ethers Oxanes Heteroaromatic compounds Vinylogous acids Oxolanes Tertiary alcohols Enoate esters Secondary alcohols Monocarboxylic acids and derivatives Acetals Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oligosaccharide - Flavonoid-3-o-glycoside - 6-methoxyflavonoid-skeleton - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - Flavone - 7-hydroxyflavonoid - Hydroxyflavonoid - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Chromone - Glycosyl compound - O-glycosyl compound - Methoxyphenol - Benzopyran - 1-benzopyran - Styrene - Anisole - Phenol ether - Catechol - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Phenol - Fatty acid ester - 1-hydroxy-4-unsubstituted benzenoid - Pyran - Oxane - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Oxolane - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Carbonyl group - Organooxygen compound - Primary alcohol - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - 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 (LMPK12112963) : Flavones and Flavonols