Structure Information
Structure

Compound Identification

SMILES

COC(=O)CNC(=O)C1=NC(NC(=O)C2=NC(NC(=O)C3=NC(NC(=O)CCC(=O)NC4=CC5=C(OCC6=CC=CC=C6)C=C6N(CC(CCl)C6=C5C=C4)C(=O)OC(C)(C)C)=CN3C)=CN2C)=CN1C

InChIKey

InChIKey=VAKGBYXTFHEIJT-UHFFFAOYSA-N

Formula

C47H51ClN12O10

Mass

979.45

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Indolecarboxylic acid - Indolecarboxylic acid derivative - Naphthalene - Indole or derivatives - 2-heteroaryl carboxamide - 1,2,4-trisubstituted-imidazole - Phenol ether - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - N-arylamide - Alkyl aryl ether - Benzenoid - Imidolactam - Fatty acyl - Fatty amide - N-substituted imidazole - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Imidazole - Methyl ester - Carbamic acid ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Monocarboxylic acid or derivatives - Alkyl chloride - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Organooxygen compound - Alkyl halide - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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