Structure Information
Structure

Compound Identification

SMILES

[H+].[H+].[Mg++].Cl.NC(CC([O-])=O)C([O-])=O.NC(CC([O-])=O)C([O-])=O.CCN(CC)CCOC(=O)C1=CC=C(N)C=C1

InChIKey

InChIKey=GRAMCUGYYSXQQQ-UHFFFAOYSA-L

Formula

C21H33ClMgN4O10

Mass

561.27

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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

Not available

Substituents

Aspartic acid or derivatives - Benzoate ester - Aminobenzoic acid or derivatives - Alpha-amino acid - Benzoic acid or derivatives - Aniline or substituted anilines - Benzoyl - Fatty acid - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid salt - Carboxylic acid ester - Organic metal halide - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organic salt - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aromatic homomonocyclic 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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