Compound Identification
SMILES
CC(C)(C)OC(=O)CN[C@H](C(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)NCC1=NC(=CS1)C(N)=N
InChIKey
InChIKey=IQKGISGMEOQAML-WNCULLNHSA-N
Formula
C31H38N6O4S
Mass
590.74
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Alpha amino acid esters Proline and derivatives Diphenylmethanes Alpha amino acid amides Pyrrolidinecarboxamides N-acylpyrrolidines Aralkylamines 2,4-disubstituted thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Dialkylamines Carboximidamides Carboxamidines Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Alpha-amino acid ester - Proline or derivatives - Diphenylmethane - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Azole - Pyrrolidine - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Amidine - Carboximidamide - Secondary amine - Carboxylic acid amidine - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - 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