Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(N(C2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C(=S)C(C#N)=C1C1=CC=C(OC)C=C1)C1=CC=CC=C1

InChIKey

InChIKey=JFVOFTLGWNTAFL-UHFFFAOYSA-N

Formula

C36H36N2O12S

Mass

720.75

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pentacarboxylic acid or derivatives - Hexose monosaccharide - 2-phenylpyridine - 4-phenylpyridine - Glycosyl compound - N-glycosyl compound - Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Anisole - Phenoxy compound - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Dihydropyridine - Alkyl aryl ether - Pyridine - Monocyclic benzene moiety - Benzenoid - Oxane - Hydropyridine - Monosaccharide - Thiolactam - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Oxacycle - Ether - Carbonitrile - Nitrile - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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

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