Compound Identification
SMILES
OC(=O)C1=CC(O)=C(O)C(O)=C1C1=C(O)C(O)=C2OC(=O)C3=C4C(OC(=O)C1=C24)=C(O)C(O)=C3C1=C(O)C(O)=C(O)C=C1C(O)=O
InChIKey
InChIKey=ZASJRRFAYSNSHU-UHFFFAOYSA-N
Formula
C28H14O18
Mass
638.402
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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 7,8-dihydroxycoumarins Gallic acids Isocoumarins and derivatives 1-benzopyrans 2-benzopyrans Pyrogallols and derivatives Benzoic acids Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives 1-hydroxy-4-unsubstituted benzenoids Heteroaromatic compounds Lactones Carboxylic acids Oxacyclic compounds Polyols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Ellagic_acid - Biphenol - 7,8-dihydroxycoumarin - Gallic acid or derivatives - Gallic acid - Coumarin - Isocoumarin - Hydroxybenzoic acid - Benzopyran - 2-benzopyran - 1-benzopyran - Benzenetriol - Benzoic acid or derivatives - Benzoic acid - Pyrogallol derivative - Benzoyl - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Oxacycle - Organoheterocyclic compound - Polyol - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - 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) 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