Compound Identification
SMILES
COC1=C(O)C=C2C(=O)OC3=C4C(=CC(O)=C3O[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](OC(C)=O)[C@H]3O)C(=O)OC1=C24
InChIKey
InChIKey=ULZKIGKDWCAPHH-BVLCZNMDSA-N
Formula
C23H20O13
Mass
504.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Tannins
- Subclass Hydrolyzable tannins
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Class
Tannins
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Tannins
Subclass
Hydrolyzable tannins
Intermediate Tree Nodes
Not available
Direct Parent
Hydrolyzable tannins
Alternative Parents
Ellagic acids and derivatives Biphenols Isocoumarins and derivatives Coumarins and derivatives 2-benzopyrans 1-benzopyrans Anisoles Fatty acid esters Dihydropyranones Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Oxanes Monosaccharides Heteroaromatic compounds Enol esters Enoate esters Secondary alcohols Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Ellagic_acid - Biphenol - Isocoumarin - Coumarin - 2-benzopyran - 1-benzopyran - Benzopyran - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Fatty acid ester - Dihydropyranone - Alkyl aryl ether - Fatty acyl - Benzenoid - Pyran - Oxane - Monosaccharide - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enol ester - Secondary alcohol - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydrolyzable tannins. These are tannins with a structure characterized by either of the following models. In model 1, the structure contains galloyl units (in some cases, shikimic acid units) that are linked to diverse polyol carbohydrate-, catechin-, or triterpenoid units. In model 2, contains at least two galloyl units C-C coupled to each other, and do not contain a glycosidically linked catechin unit.
External Descriptors
Not available