Structure Information
Structure

Compound Identification

SMILES

C[C@H](NC(CCCN=C(N)N)C(O)CC(=O)OCC1=C(N2C(SC1)C(NC=O)(NC(=O)CCCC(NC(C)=O)C(O)=O)C2=O)C(O)=O)C(=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(C)=O

InChIKey

InChIKey=YKILQUADBLWTCN-FJANOWQUSA-N

Formula

C36H55N11O15S

Mass

913.96

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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

Aliphatic heteropolycyclic compounds

Substituents

Alpha-dipeptide - Cephalosporin 3'-ester - Cephalosporin - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - N-formyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-formyl-alpha-amino acid - Gamma amino acid or derivatives - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Cephem - Beta-hydroxy acid - Fatty acid ester - Fatty amide - Fatty acyl - Hydroxy acid - N-acyl-amine - Meta-thiazine - Carboxylic acid imide - Tertiary carboxylic acid amide - Acetamide - Beta-lactam - Carboxylic acid imide, n-unsubstituted - Dicarboximide - 1,2-aminoalcohol - Amino acid - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid ester - Guanidine - Secondary carboxylic acid amide - Lactam - Secondary alcohol - Propargyl-type 1,3-dipolar organic compound - Secondary aliphatic amine - Organic 1,3-dipolar compound - Dialkylthioether - Carboxylic acid - Organoheterocyclic compound - Secondary amine - Thioether - Hemithioaminal - Azacycle - Carboximidamide - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Organic oxide - Organooxygen compound - Aliphatic 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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