Compound Identification
SMILES
OC[C@@H]1O[C@@H](OC2=CC(O)=C3C(OC(C4=CC(O)=C(O)C=C4)=C(O[C@@H]4O[C@@H](COC(=O)\C=C\C5=CC=C(O)C=C5)[C@@H](O)[C@@H](O)[C@H]4O)C3=O)=C2)[C@H](O)[C@H](O)[C@@H]1O
InChIKey
InChIKey=VASHBWYFPVZWGX-ZWURVBGRSA-N
Formula
C36H36O19
Mass
772.665
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
- 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-p-coumaroyl glycosides
Alternative Parents
Flavonoid-3-O-glycosides Flavonoid-7-O-glycosides 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids Flavones Phenolic glycosides Coumaric acid esters Cinnamic acid esters Coumaric acids and derivatives Chromones O-glycosyl compounds Styrenes Catechols 1-hydroxy-4-unsubstituted benzenoids Fatty acid esters Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Monosaccharides Oxanes Heteroaromatic compounds Vinylogous acids Enoate esters Secondary alcohols Monocarboxylic acids and derivatives Oxacyclic compounds Polyols Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavonoid 3-o-6-p-coumaroyl-glycoside - Flavonoid-3-o-glycoside - Flavonoid-7-o-glycoside - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - Hydroxyflavonoid - 5-hydroxyflavonoid - Flavone - Phenolic glycoside - Coumaric acid ester - Coumaric acid or derivatives - Cinnamic acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - O-glycosyl compound - Glycosyl compound - Chromone - 1-benzopyran - Benzopyran - Styrene - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Fatty acid ester - Phenol - Pyranone - Oxane - Pyran - Monocyclic benzene moiety - Monosaccharide - Fatty acyl - Benzenoid - Heteroaromatic compound - Vinylogous acid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Acetal - Polyol - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Alcohol - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavonoid 3-o-p-coumaroyl glycosides. These are flavonoid 3-O-glycosides where the carbohydrate moiety is esterified with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring.
External Descriptors
Not available