Compound Identification
SMILES
O[C@@H]1[C@@H](O)[C@H](OC2=C(O)C=C(O)C3=C2OC(C2=CC(O)=C(O)C=C2)=C(OS([O-])(=O)=O)C3=O)O[C@@H]([C@H]1O)C(O)=O
InChIKey
InChIKey=HUZYIABAGFALTN-WNOSPCDLSA-M
Formula
C21H17O17S
Mass
573.41
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
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Level 6
Flavonoid O-glucuronides
- Level 7 Flavonoid-8-O-glucuronides
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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
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavonoid glycosides
Intermediate Tree Nodes
Flavonoid O-glycosides - Flavonoid O-glucuronides
Direct Parent
Flavonoid-8-O-glucuronides
Alternative Parents
Flavonoid-8-O-glycosides 3-sulfated flavonoids 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Flavones Phenolic glycosides O-glucuronides Chromones O-glycosyl compounds Arylsulfates Catechols 1-hydroxy-4-unsubstituted benzenoids Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Beta hydroxy acids and derivatives Oxanes Monosaccharides Sulfuric acid monoesters Benzene and substituted derivatives Vinylogous acids Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Carboxylic acids Acetals Polyols Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonoid-8-o-glucuronide - Flavonoid-8-o-glycoside - 3-sulfated flavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Flavone - 5-hydroxyflavonoid - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - Phenolic glycoside - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Chromone - 1-benzopyran - Benzopyran - Arylsulfate - Catechol - 1-hydroxy-4-unsubstituted benzenoid - Beta-hydroxy acid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Pyran - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Monosaccharide - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Oxane - Vinylogous acid - Heteroaromatic compound - Organic sulfuric acid or derivatives - Secondary alcohol - Carboxylic acid - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Acetal - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Carbonyl group - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonoid-8-o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C8-position.
External Descriptors
Not available