Compound Identification
SMILES
OC(=O)[C@H](CCC(=O)N1CCC(CNC2=NC=CC(=N2)C(F)(F)F)CC1)NC(=O)[C@@H]1CCCN1S(=O)(=O)C1=CC(Cl)=CC(Cl)=C1
InChIKey
InChIKey=ZTSNKZQOLAEYGH-SFTDATJTSA-N
Formula
C27H31Cl2F3N6O6S
Mass
695.54
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
Glutamine and derivatives N-acyl-L-alpha-amino acids Proline and derivatives Alpha amino acid amides Benzenesulfonamides Benzenesulfonyl compounds N-acylpiperidines Dichlorobenzenes Pyrrolidinecarboxamides Aminopyrimidines and derivatives Aryl chlorides Organosulfonamides Tertiary carboxylic acid amides Heteroaromatic compounds Sulfonyls Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Amines Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Glutamine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Proline or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Alpha-amino acid or derivatives - Benzenesulfonyl group - N-acyl-piperidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Aminopyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Pyrimidine - Organosulfonic acid amide - Tertiary carboxylic acid amide - Sulfonyl - Heteroaromatic compound - Pyrrolidine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organosulfur compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organofluoride - 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