Compound Identification
SMILES
COC1O[C@@H]2COC(=O)C3=CC(OC)=C(OC)C(OC)=C3OC3=C(OC)C=C4C(=O)OC5=C(OC)C(OC)=C(C6=C5C4=C3OC6=O)C3=C(OC)C(OC)=C(OC)C=C3C(=O)O[C@H]2[C@@H]2OC(=O)C3=CC(OC)=C(OC)C(OC)=C3C3=C(OC)C(OC)=C(OC)C=C3C(=O)O[C@@H]12
InChIKey
InChIKey=OHZDYVBJGQMNIP-AMGWDVLQSA-N
Formula
C64H60O30
Mass
1309.154
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
Ellagic acids and derivatives Tetracarboxylic acids and derivatives Gallic acid and derivatives Isocoumarins and derivatives Diarylethers Coumarins and derivatives 1-benzopyrans 2-benzopyrans Anisoles Pyranones and derivatives Alkyl aryl ethers Oxanes Monosaccharides Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Acetals Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Ellagic_acid - Tetracarboxylic acid or derivatives - Gallic acid or derivatives - Coumarin - Diaryl ether - Isocoumarin - Benzopyran - 1-benzopyran - 2-benzopyran - Anisole - Pyranone - Alkyl aryl ether - Pyran - Oxane - Monosaccharide - Benzenoid - Heteroaromatic compound - Lactone - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - 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