Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@H](N[C@@H]1N(CC2=CC3=C(OCO3)C=C2[N+]([O-])=O)S(=O)(=O)NC1=O)C(O)=O

InChIKey

InChIKey=BILRBVFNQYVWCJ-QWHCGFSZSA-N

Formula

C15H18N4O9S

Mass

430.39

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

Valine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Valine or derivatives - L-alpha-amino acid - Benzodioxole - Nitroaromatic compound - Benzenoid - Organic sulfuric acid or derivatives - Thiadiazolidine - C-nitro compound - Organic nitro compound - Acetal - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Azacycle - Organooxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic salt - Carbonyl group - Organopnictogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine 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