Compound Identification
SMILES
N[C@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)C1CCC[C@@H]2N[C@](C(C(=O)C3=NC=CC4=C3CCCC4)[C@@]12C(=O)CNC(=O)[C@@H]1CC(O)CN1)(C(O)=O)C(=O)[C@H](CO)NC(=O)[C@@H](N)CC1=CC=CS1
InChIKey
InChIKey=NZVSWJBJOVGTMD-HBRAAJGISA-N
Formula
C53H77N15O12S
Mass
1148.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Peptides
- Level 6 Dipeptides
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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
N-acyl-alpha amino acids and derivatives Proline and derivatives Alpha amino acid amides D-alpha-amino acids Indolines Aryl alkyl ketones Gamma-keto acids and derivatives Pyrrolidinecarboxamides Pyrrolidine carboxylic acids N-acylpyrrolidines Aralkylamines Beta-keto acids and derivatives N-acyl amines Pyridines and derivatives Gamma-amino ketones Beta-amino ketones Beta-hydroxy ketones Alpha-amino ketones Tertiary carboxylic acid amides Heteroaromatic compounds Thiophenes Amino acids 1,2-aminoalcohols Guanidines Secondary alcohols Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carboximidamides Carboxylic acids Organic oxides Primary alcohols Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid - Alpha-amino acid or derivatives - D-alpha-amino acid - Indole or derivatives - Dihydroindole - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - N-acylpyrrolidine - Gamma-keto acid - Pyrrolidine carboxylic acid - Aryl alkyl ketone - Aryl ketone - Aralkylamine - Beta-keto acid - Keto acid - N-acyl-amine - Gamma-aminoketone - Fatty acyl - Fatty amide - Pyridine - Beta-aminoketone - Beta-hydroxy ketone - Heteroaromatic compound - Alpha-aminoketone - Pyrrolidine - Tertiary carboxylic acid amide - Thiophene - Amino acid or derivatives - Ketone - Amino acid - 1,2-aminoalcohol - Guanidine - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - 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