Structure Information
Structure

Compound Identification

SMILES

OC1=C(Br)C=C(C=C2SC(=O)N(CC(=O)N3CCCCCC3)C2=O)C=C1I

InChIKey

InChIKey=KJBGFXOASSNLBB-UHFFFAOYSA-N

Formula

C18H18BrIN2O4S

Mass

565.22

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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 - 2-halophenol - 2-bromophenol - 2-iodophenol - Azepane - Iodobenzene - Thiazolidinedione - Halobenzene - Phenol - Bromobenzene - Aryl bromide - Aryl halide - Aryl iodide - Benzenoid - Monocyclic benzene moiety - Thiazolidine - Tertiary carboxylic acid amide - Dicarboximide - Carbonic acid derivative - Thiocarbamic acid derivative - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Organoiodide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - 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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