Compound Identification
SMILES
OC(=O)C1=CC(O)=C(O)C(O)=C1OC1=C(O)C(O)=C2C(=C1)C(=O)OCC1OC(OC(=O)C3=CC(O)=C(O)C(O)=C3)C3OC(=O)C4=CC(O)=C(O)C5=C4C4C(=CC(=O)C(O)(O5)C4(O)O)C(=O)OC1C3OC(=O)C1=CC(O)=C(O)C(O)=C21
InChIKey
InChIKey=IHHYLDUUGFQCFR-UHFFFAOYSA-N
Formula
C48H32O32
Mass
1120.752
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
Hexacarboxylic acids and derivatives Saccharolipids Galloyl esters Macrolides and analogues Gallic acids p-Hydroxybenzoic acid alkyl esters m-Hydroxybenzoic acid esters Diarylethers 1-benzopyrans Pyrogallols and derivatives Benzoic acids Phenoxy compounds Phenol ethers Benzoyl derivatives Cyclohexenones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Oxanes Monosaccharides Enoate esters Lactones Hemiacetals Carboxylic acids Carbonyl hydrates Polyols Acetals Oxacyclic compounds Hydrocarbon derivatives Organic oxides Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Hexacarboxylic acid or derivatives - Saccharolipid - Macrolide - Galloyl ester - Gallic acid or derivatives - Gallic acid - Dihydroxybenzoic acid - P-hydroxybenzoic acid alkyl ester - M-hydroxybenzoic acid ester - P-hydroxybenzoic acid ester - Diaryl ether - Hydroxybenzoic acid - 1-benzopyran - Benzoate ester - Benzopyran - Chromane - Pyrogallol derivative - Benzoic acid or derivatives - Benzoic acid - Benzenetriol - Phenol ether - Phenoxy compound - Benzoyl - Cyclohexenone - 1-hydroxy-4-unsubstituted benzenoid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Oxane - Monosaccharide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Ketone - Hemiacetal - Lactone - Carboxylic acid ester - Polyol - Acetal - Oxacycle - Organoheterocyclic compound - Ether - Carbonyl hydrate - Carboxylic acid derivative - Carboxylic acid - Organooxygen compound - Aldehyde - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - 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