Structure Information
Structure

Compound Identification

SMILES

[Na].COC1=CC=C(N\N=C2\C(=O)C3=C(C=C(NC4=NC(=NC(Cl)=N4)N(CCC(N)=O)CCC(N)=O)C=C3)C=C2S(O)(=O)=O)C=C1

InChIKey

InChIKey=FGGWIXSBOVBYKS-VOORSFRPSA-N

Formula

C26H26ClN9NaO7S

Mass

667.05

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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Naphthalene - Methoxyaniline - Aryl ketone - Phenoxy compound - 2,4-diamine-s-triazine - Dialkylarylamine - Anisole - Phenylhydrazine - Phenol ether - Methoxybenzene - Aminotriazine - N-aliphatic s-triazine - Amino-1,3,5-triazine - Halo-s-triazine - Chloro-s-triazine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Ketone - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Hydrazone - Ether - Hydrocarbon derivative - Amine - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

Previous Back Next