Compound Identification
SMILES
CC(=O)OC[C@@]1(O[C@H]2O[C@H](CO)[C@@H](OC(C)=O)[C@H](O)[C@H]2OC(=O)\C=C\C2=CC=C(O)C=C2)O[C@H](COC(=O)\C=C\C2=CC=C(O)C=C2)[C@@H](O)[C@@H]1OC(=O)\C=C\C1=CC=C(O)C=C1
InChIKey
InChIKey=AGITZPRBGCTZIK-LVQIUFOQSA-N
Formula
C43H44O19
Mass
864.806
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Pentacarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pentacarboxylic acids and derivatives
Alternative Parents
Coumaric acid esters Cinnamic acid esters Coumaric acids and derivatives C-glycosyl compounds O-glycosyl compounds Disaccharides Styrenes 1-hydroxy-2-unsubstituted benzenoids Ketals Fatty acid esters Oxanes Tetrahydrofurans Enoate esters Secondary alcohols Oxacyclic compounds Organic oxides Carbonyl compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Coumaric acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - O-glycosyl compound - C-glycosyl compound - Glycosyl compound - Disaccharide - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Ketal - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Oxane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - Acetal - Oxacycle - Alcohol - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pentacarboxylic acids and derivatives. These are carboxylic acids containing exactly five carboxyl groups.
External Descriptors
Not available