Structure Information
Structure

Compound Identification

SMILES

NNC(=O)C1=CC=NC=C1.CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)C3=CC=C(O)C=C3)C(=O)N2[C@H]1C(O)=O.CC1=C(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)C(=NO1)C1=CC=CC=C1Cl

InChIKey

InChIKey=VLTXTFRSGUZHND-GZWHKQFISA-N

Formula

C41H44ClN9O11S2

Mass

938.43

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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

Not available

Substituents

Alpha-dipeptide - Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Phenylacetamide - Pyridine carboxylic acid or derivatives - Penam - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Aralkylamine - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Pyridine - Aryl chloride - Isoxazole - Azole - Thiazolidine - Tertiary carboxylic acid amide - Beta-lactam - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Carboxylic acid hydrazide - Lactam - Secondary carboxylic acid amide - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Oxacycle - Dialkylthioether - Organoheterocyclic compound - Azacycle - Carboxylic acid - Primary amine - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary aliphatic amine - Organic oxide - Aromatic heteropolycyclic 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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