Structure Information
Structure

Compound Identification

SMILES

CC(=C)[C@@H](N1[C@H](SSC2=NC3=CC=CC=C3S2)\C(=C/C2=CC=C(C=C2)[N+]([O-])=O)C1=O)C(=O)OC(C)(C)C

InChIKey

InChIKey=YHWBRLJBNYBQQP-OACXUXEDSA-N

Formula

C26H25N3O5S3

Mass

555.68

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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 heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Nitrobenzene - 1,3-benzothiazole - Nitroaromatic compound - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Beta-lactam - Lactam - C-nitro compound - Azetidine - Organic disulfide - Carboxylic acid ester - Carboxamide group - Tertiary amine - Organic nitro compound - Organic oxoazanium - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Sulfenyl compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - 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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