Compound Identification
SMILES
[H]\C(C)=C(/C)C(=O)O[C@@]1([H])C2=CC(OC)=C(OC)C(=O)[C@@]22COC3=C2C(=CC2=C3OCO2)[C@]([H])(OC(C)=O)[C@]([H])(C)[C@]1(C)O
InChIKey
InChIKey=QNFYCWCWXXQCGR-NHVPGISVSA-N
Formula
C29H32O11
Mass
556.564
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
Coumarans Benzodioxoles Fatty acid esters Alkyl aryl ethers Dicarboxylic acids and derivatives Benzenoids Vinylogous esters Tertiary alcohols Enoate esters Ketones Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydrolyzable tannin - Benzodioxole - Coumaran - Alkyl aryl ether - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary alcohol - Carboxylic acid ester - Ketone - Acetal - Carboxylic acid derivative - Oxacycle - Ether - Organoheterocyclic compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen 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) 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