Compound Identification
SMILES
CSC1=CC=CC(NC(=O)NC2CCN(C2C(=O)NC(CCCNC(=O)C2=NC=CN=C2)C(N)=O)C(=O)C2=NC=CN=C2)=C1
InChIKey
InChIKey=CCQDHDRRCKYCFH-UHFFFAOYSA-N
Formula
C28H32N10O5S
Mass
620.69
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
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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 N-phenylureas Pyrazinecarboxamides 2-heteroaryl carboxamides Thiophenol ethers Pyrrolidinecarboxamides N-acylpyrrolidines Alkylarylthioethers Fatty amides Heteroaromatic compounds Tertiary carboxylic acid amides Primary carboxylic acid amides Secondary carboxylic acid amides Ureas Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - N-phenylurea - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - 2-heteroaryl carboxamide - Aryl thioether - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Thiophenol ether - Alkylarylthioether - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Pyrazine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Urea - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Thioether - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur 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