Compound Identification
SMILES
O[C@@H]1[C@@H](O)[C@H](OC2=C(O)C3=C(C(=O)CC(O3)C3=CC=C(O)C=C3)C(O)=C2)O[C@@H]([C@H]1O)C(O)=O
InChIKey
InChIKey=UJLSJQIWIUCLAS-DRAXSFGVSA-N
Formula
C21H20O12
Mass
464.379
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-7-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
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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 - Flavonoid O-glucuronides
Direct Parent
Flavonoid-7-O-glucuronides
Alternative Parents
Flavonoid-7-O-glycosides 4'-hydroxyflavonoids 5-hydroxyflavonoids 8-hydroxyflavonoids Flavanones Fatty acyl glycosides of mono- and disaccharides Phenolic glycosides O-glucuronides Alkyl glycosides Hexoses O-glycosyl compounds Chromones Aryl alkyl ketones Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Beta hydroxy acids and derivatives Pyrans Oxanes Benzene and substituted derivatives Vinylogous acids Secondary alcohols Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Carboxylic acids Polyols Aldehydes Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonoid-7-o-glucuronide - Flavonoid-7-o-glycoside - Hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - 8-hydroxyflavonoid - Flavanone - Flavan - Fatty acyl glycoside - Phenolic glycoside - Fatty acyl glycoside of mono- or disaccharide - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Hexose monosaccharide - Alkyl glycoside - O-glycosyl compound - Chromone - Glycosyl compound - 1-benzopyran - Chromane - Benzopyran - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Beta-hydroxy acid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyran - Monosaccharide - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Fatty acyl - Oxane - Vinylogous acid - Secondary alcohol - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Polyol - Organoheterocyclic compound - Oxacycle - Acetal - Ether - Carbonyl group - Organooxygen compound - Organic oxygen compound - Aldehyde - Alcohol - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonoid-7-o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position.
External Descriptors
Not available