Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)OC[C@H]2O[C@@](COC(=O)\C=C\C3=CC=C(O)C=C3)(O[C@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3OC(C)=O)[C@@H](OC(=O)\C=C\C3=CC=C(O)C=C3)[C@@H]2O)=C1
InChIKey
InChIKey=QHZJEIGSGZHOHS-ZSXKYDPFSA-N
Formula
C44H46O20
Mass
894.832
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 Disaccharides O-glycosyl compounds Methoxyphenols Anisoles Styrenes Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty acid esters Ketals 1-hydroxy-2-unsubstituted benzenoids Oxanes Enoate esters Tetrahydrofurans Secondary alcohols Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pentacarboxylic acid or derivatives - Coumaric acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Coumaric acid or derivatives - Cinnamic acid or derivatives - O-glycosyl compound - Glycosyl compound - Disaccharide - C-glycosyl compound - Methoxyphenol - Phenol ether - Phenoxy compound - Styrene - Anisole - Methoxybenzene - Fatty acid ester - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Ketal - Phenol - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tetrahydrofuran - Carboxylic acid ester - Secondary alcohol - Ether - Organoheterocyclic compound - Oxacycle - Acetal - Organic oxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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