Structure Information
Structure

Compound Identification

SMILES

NC(CC(O)=O)C(=O)OCC1=C(N2CC(NC(=O)CC3=CC=CC=C3)C2SC1)C(O)=O

InChIKey

InChIKey=IFNYHCTURYJUEK-UHFFFAOYSA-N

Formula

C20H23N3O7S

Mass

449.48

Export to:

JSON SDF CSV

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

Aromatic heteropolycyclic compounds

Substituents

Aspartic acid or derivatives - Alpha-amino acid ester - Phenylacetamide - Tricarboxylic acid or derivatives - Fatty acid ester - Meta-thiazine - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azetidine - Carboxamide group - Carboxylic acid ester - Amino acid - Secondary carboxylic acid amide - Dialkylthioether - Organoheterocyclic compound - Azacycle - Hemithioaminal - Carboxylic acid - Enamine - Thioether - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic 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

Previous Back Next