Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H](N)C(=O)OCC[C@H](NC(=O)[C@@H]1SCCN1S(=O)(=O)C1=CC=C(C=C1)C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=BGGHFAFJRYNEEU-GKRYNVPLSA-N

Formula

C30H35N3O5S2

Mass

581.75

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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

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Valine or derivatives - Biphenyl - Benzenesulfonamide - Benzenesulfonyl group - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Thiazolidine - Sulfonyl - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Thioether - Dialkylthioether - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Primary amine - Organonitrogen compound - Primary aliphatic amine - Organooxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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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