Compound Identification
SMILES
CCCCCCCCOC1=C(OC(=O)CCCCC)C=C2C(=O)OC3=C4C(=CC(OC(=O)CCCCC)=C3OCCCCCCCC)C(=O)OC1=C24
InChIKey
InChIKey=WIMNSJGYRWZNHP-UHFFFAOYSA-N
Formula
C42H58O10
Mass
722.916
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 Isocoumarins and derivatives Coumarins and derivatives Phenol esters 1-benzopyrans 2-benzopyrans Phenol ethers Pyranones and derivatives Alkyl aryl ethers Fatty acid esters Dicarboxylic acids and derivatives Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Ellagic_acid - Coumarin - Isocoumarin - Benzopyran - Phenol ester - 2-benzopyran - 1-benzopyran - Phenol ether - Alkyl aryl ether - Fatty acid ester - Pyranone - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Pyran - Heteroaromatic compound - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Ether - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Carbonyl group - 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