Compound Identification
SMILES
CC[C@H](C)[C@H](N)C(=O)N[C@@H](COC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)N[C@H](C(C)C)C1=NC(=CS1)C(=O)OCC=C
InChIKey
InChIKey=MIODSFTXXFLTHW-LQUMWQQKSA-N
Formula
C39H46N4O5S
Mass
682.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
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
Triphenyl compounds Isoleucine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzylethers Thiazolecarboxylic acids and derivatives 2,4-disubstituted thiazoles N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Triphenyl compound - Isoleucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzylether - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Fatty acyl - Benzenoid - Monocyclic benzene moiety - N-acyl-amine - Fatty amide - Heteroaromatic compound - Thiazole - Azole - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Primary aliphatic amine - Organic oxygen compound - Organic oxide - 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