Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](CCSC)NC(=O)[C@]1(C[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](C1)OC(C)=O)OC(C)=O

InChIKey

InChIKey=WMVNBHGOGIKWIW-GFZGVUQPSA-N

Formula

C21H31NO11S

Mass

505.54

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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

Aliphatic homomonocyclic compounds

Substituents

Pentacarboxylic acid or derivatives - Methionine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Fatty acid ester - Cyclitol or derivatives - Fatty acyl - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Sulfenyl compound - Thioether - Dialkylthioether - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aliphatic homomonocyclic 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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