Structure Information
Structure

Compound Identification

SMILES

NC(CC(=O)OCCCCC(CO[N+]([O-])=O)OON=O)C(=O)OCCCCC(CO[N+]([O-])=O)O[N+]([O-])=O

InChIKey

InChIKey=HROYGRJOJYLFJT-UHFFFAOYSA-N

Formula

C16H27N5O16

Mass

545.411

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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 - Alpha-amino acid ester - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Alkyl nitrate - Organic nitrate - Organic peroxynitrite - Organic o-nitroso compound - Carboxylic acid ester - Organic nitro compound - Organic nitric acid or derivatives - Organic nitroso compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary amine - Organic zwitterion - Organic salt - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - 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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