Structure Information
Structure

Compound Identification

SMILES

CN(C)CCCNC(=O)CCNC(=O)C1=CC(NC(=O)C2=CC(NC(=O)CCNC(=O)C3=CC(NC(=O)C4=CC(NC(=O)C5=CC=C(NC(=O)C6=NSC(NCCCN(C)C)=C6Cl)S5)=CN4C)=CN3C)=CN2C)=CN1C

InChIKey

InChIKey=WPBBWKLOJLOENS-UHFFFAOYSA-N

Formula

C49H63ClN16O8S2

Mass

1103.72

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - 2,5-disubstituted thiophene - 1,2-thiazolamine - Aryl chloride - Aryl halide - N-methylpyrrole - Substituted pyrrole - Vinylogous halide - Thiophene - Azole - Pyrrole - Heteroaromatic compound - Thiazole - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Organic oxide - Organohalogen compound - Amine - Organochloride - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic 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

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