Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C2SC(=S)N(CC(=O)NCCC[NH+]3CCOCC3)C2=O)C=C1

InChIKey

InChIKey=ACWGZZSKUKTWQL-UHFFFAOYSA-O

Formula

C20H26N3O3S2

Mass

420.57

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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

Direct Parent

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Toluene - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Quaternary ammonium salt - Dithiocarbamic acid ester - Thiazolidine - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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