Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H]1CCCN2CCC[C@H](N2C1=O)C(O)=O.COC1=CC=CC=C1OC1=C(NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)N=C(N=C1OCCO)C1=NC=CC=N1

InChIKey

InChIKey=NZVSOYSTPNIWAG-HGNFKMEKSA-N

Formula

C49H60N8O11S

Mass

969.12

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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

Alpha amino acid esters

Alternative Parents

Molecular Framework

Not available

Substituents

Alpha-amino acid ester - Bipyrimidine - Diaryl ether - Benzenesulfonamide - Benzenesulfonyl group - Phenylpropane - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 1,2-diazepane - Alkyl aryl ether - Fatty acid ester - Aralkylamine - Diazepane - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - 1,2-diazinane - Fatty acyl - Imidolactam - Organosulfonic acid amide - Benzenoid - Pyrimidine - Pyridazine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Aminosulfonyl compound - Amino acid - Carboxylic acid ester - Carboxylic acid hydrazide - Ether - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Secondary amine - Alcohol - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Amine - Organic nitrogen compound - Primary alcohol - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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