Compound Identification
SMILES
OC1=C(O)C(O)=C(OC2=C(O)C3=C4C(=C2)C(=O)OC2=C4C(=CC(O)=C2O)C(=O)O3)C=C1
InChIKey
InChIKey=LGMNKSBINQXDAI-UHFFFAOYSA-N
Formula
C20H10O11
Mass
426.289
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Tannins
- Subclass Hydrolyzable tannins
-
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 7,8-dihydroxycoumarins Isocoumarins and derivatives Diarylethers 1-benzopyrans 2-benzopyrans 5-unsubstituted pyrrogallols Phenoxy compounds Phenol ethers Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Heteroaromatic compounds Lactones Polyols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Ellagic_acid - 7,8-dihydroxycoumarin - Diaryl ether - Coumarin - Isocoumarin - Benzopyran - 2-benzopyran - 1-benzopyran - Benzenetriol - 5-unsubstituted pyrrogallol - Pyrogallol derivative - Phenoxy compound - Phenol ether - Phenol - Pyranone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Pyran - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Lactone - Ether - Polyol - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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