Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CN[C@H]([C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)CSC2=NN=C(C)S2)C(C)(C)C)C(=O)NC2C(O)CC3=CC=CC=C23)C=C1

InChIKey

InChIKey=KFHIVQMHNDDSKC-UUHCDIPASA-N

Formula

C39H48N6O6S2

Mass

760.97

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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

Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Indane - Phenoxy compound - Aryl thioether - Anisole - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Thiadiazole - Azole - Heteroaromatic compound - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Organoheterocyclic compound - Thioether - Secondary amine - Azacycle - Ether - Secondary aliphatic amine - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - 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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