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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Peptides
- Level 6 Dipeptides
-
Level 5
Peptides
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Cephalosporin 3'-esters N-acyl-alpha amino acids Alpha amino acid amides Gamma amino acids and derivatives N-formyl-alpha amino acids Alanine and derivatives Tricarboxylic acids and derivatives Beta hydroxy acids and derivatives Fatty acid esters 1,3-thiazines N-acyl amines Acetamides Tertiary carboxylic acid amides Dicarboximides N-unsubstituted carboxylic acid imides Guanidines Secondary carboxylic acid amides Amino acids Azetidines Secondary alcohols Carboxylic acid esters 1,2-aminoalcohols Carboximidamides Thiohemiaminal derivatives Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Dialkylamines Dialkylthioethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
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