Compound Identification
SMILES
COC1=CC(O[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@H]2O)=C(C=C1)C(C)=O
InChIKey
InChIKey=RUAYDWCAPDNACJ-NFEAGSSZSA-N
Formula
C27H32O16
Mass
612.537
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Tannins
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Tannins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tannins
Alternative Parents
Phenolic glycosides Galloyl esters Alkyl-phenylketones p-Hydroxybenzoic acid alkyl esters m-Hydroxybenzoic acid esters Disaccharides O-glycosyl compounds Pyrogallols and derivatives Acetophenones Benzoyl derivatives Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Oxanes Secondary alcohols Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Polyols Hydrocarbon derivatives Organic oxides Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tannin - Phenolic glycoside - Galloyl ester - Alkyl-phenylketone - Gallic acid or derivatives - Glycosyl compound - O-glycosyl compound - P-hydroxybenzoic acid ester - M-hydroxybenzoic acid ester - P-hydroxybenzoic acid alkyl ester - Disaccharide - Benzoate ester - Acetophenone - Phenylketone - Benzoic acid or derivatives - Pyrogallol derivative - Benzenetriol - Phenoxy compound - Benzoyl - Anisole - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Oxane - Monocyclic benzene moiety - Benzenoid - Ketone - Secondary alcohol - Carboxylic acid ester - Acetal - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Organic oxygen compound - Alcohol - Aldehyde - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tannins. These are naturally occurring polyphenols which be categorized into four main classes: hydrolyzable tannin (based on ellagic acid or gallic acid), condensed tannins (made of oligomeric or polymeric proanthocyanidins), complex tannins (made of a catechin bound to a gallotannin or elagitannin), and phlorotannins (oligomers of phloroglucinol).
External Descriptors
Not available