Structure Information
Structure

Compound Identification

SMILES

CC[N+](CC)=CC.CCOC(=O)CN1C(=S)N(C(=O)C1=CC=C1OC2=CC=CC=C2N1CCCCS(O)(=O)=O)C1=CC=CC=C1

InChIKey

InChIKey=IUPJSABDSGQIPS-UHFFFAOYSA-N

Formula

C32H41N4O7S2

Mass

657.82

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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 - Phenylimidazolidine - N-phenylthiourea - Benzoxazoline - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Imidazolidine - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Organosulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Carboxylic acid ester - Ketene acetal or derivatives - Shiff base - Thiourea - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen 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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