Structure Information
Structure

Compound Identification

SMILES

CN(CCCN(C)C(CC(O)=O)C(=O)OS)CCC(O)O

InChIKey

InChIKey=NQHMICDTUBHBDY-UHFFFAOYSA-N

Formula

C12H24N2O6S

Mass

324.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Aspartic acid or derivatives - Dicarboxylic acid or derivatives - Fatty acid - 1,3-aminoalcohol - Tertiary amine - Amino acid - Tertiary aliphatic amine - Carbonyl hydrate - Carboxylic acid - Os-thioperoxol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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