Compound Identification
SMILES
COC1=CC(C=CCOC(=O)CC(C)(CC(O)=O)OC(=O)C2(O)CC(O)C(O)C(C2)OC(C)=O)=CC(O)=C1OC1OC(CO)C(O)C(O)C1O
InChIKey
InChIKey=APFZZFOFVLPZOR-UHFFFAOYSA-N
Formula
C31H42O19
Mass
718.658
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
Phenolic glycosides Tetracarboxylic acids and derivatives Quinic acids and derivatives Hexoses O-glycosyl compounds Methoxyphenols Anisoles Methoxybenzenes Styrenes Phenoxy compounds 1-hydroxy-4-unsubstituted benzenoids Fatty acid esters Cyclohexanols 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Oxanes Tertiary alcohols Carboxylic acid esters Acetals Carboxylic acids Oxacyclic compounds Polyols Organic oxides Primary alcohols Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydrolyzable tannin - Phenolic glycoside - Quinic acid - Tetracarboxylic acid or derivatives - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Methoxyphenol - Phenol ether - Anisole - Phenoxy compound - Methoxybenzene - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Cyclohexanol - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Monosaccharide - Cyclitol or derivatives - Benzenoid - Oxane - Cyclic alcohol - Tertiary alcohol - Carboxylic acid ester - Secondary alcohol - Polyol - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Acetal - Organoheterocyclic compound - Ether - Carbonyl group - Organic oxygen compound - Primary alcohol - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic heteromonocyclic 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