Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)O[C@@H]2[C@@H](O[C@@H]3[C@@H](OC4=CC=C(C=C4)C4=CC(=O)C5=C(O)C=C(O)C=C5O4)O[C@H]([C@H](O)[C@H]3O)C(O)=O)O[C@H]([C@H](O)[C@H]2O)C(O)=O)=C1
InChIKey
InChIKey=LNCLTICCQWMCNS-ZPPGLCOLSA-N
Formula
C37H34O20
Mass
798.659
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 O-glucuronides
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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 O-glucuronides
Alternative Parents
5-hydroxyflavonoids Flavones 7-hydroxyflavonoids Fatty acyl glycosides of mono- and disaccharides Phenolic glycosides O-glucuronides Alkyl glycosides Coumaric acids and derivatives Cinnamic acid esters Disaccharides O-glycosyl compounds Chromones Methoxyphenols Tricarboxylic acids and derivatives Methoxybenzenes Phenoxy compounds Anisoles Styrenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Pyranones and derivatives Beta hydroxy acids and derivatives Fatty acid esters Oxanes Heteroaromatic compounds Enoate esters Vinylogous acids Secondary alcohols Carboxylic acids Acetals Oxacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonoid-4p-o-glucuronide - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Flavone - Phenolic glycoside - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Alkyl glycoside - Cinnamic acid ester - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - Coumaric acid or derivatives - O-glycosyl compound - Glycosyl compound - Chromone - Disaccharide - Benzopyran - Methoxyphenol - 1-benzopyran - Tricarboxylic acid or derivatives - Phenoxy compound - Phenol ether - Methoxybenzene - Anisole - Styrene - Beta-hydroxy acid - Fatty acid ester - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Pyranone - Benzenoid - Hydroxy acid - Oxane - Fatty acyl - Monocyclic benzene moiety - Pyran - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous acid - Heteroaromatic compound - Carboxylic acid ester - Secondary alcohol - Carboxylic acid - Carboxylic acid derivative - Ether - Oxacycle - Organoheterocyclic compound - Acetal - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonoid o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid.
External Descriptors
Not available