Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CS)C(=O)SC1CC(=O)N(CCCC[C@H](NC(=O)CNC(=O)C2=CC([131I])=CC=C2)C(O)=O)C1=O

InChIKey

InChIKey=VFOWLKWBRPWFMD-WQRZDOTLSA-N

Formula

C22H27IN4O7S2

Mass

654.51

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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

Peptides

Direct Parent

Dipeptides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - N-acyl-l-alpha-amino acid - Hippuric acid or derivatives - Alpha-amino acid amide - Cysteine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Medium-chain fatty acid - Benzoyl - Iodobenzene - Heterocyclic fatty acid - Halogenated fatty acid - Halobenzene - Fatty acyl - Aryl iodide - Aryl halide - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Fatty acid - Benzenoid - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Amino acid or derivatives - Amino acid - Carbothioic s-ester - Carboxamide group - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Lactam - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Alkylthiol - Carboxylic acid - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organopnictogen compound - Carbonyl group - Organohalogen compound - Primary amine - Organosulfur compound - Hydrocarbon derivative - Organoiodide - Organic oxide - Organooxygen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

External Descriptors

Not available

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