Compound Identification
SMILES
CC(C)[C@H](NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@H](CSC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C)NC(=O)C1=CC=C(C=C1)C(=O)NS(=O)(=O)C1=CC=C(Cl)C=C1)C(=O)C(F)(F)F
InChIKey
InChIKey=GOJDEHQCNCQXBP-POCWEVLXSA-N
Formula
C46H56ClF3N4O8S2
Mass
949.54
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
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzenesulfonamides Phenylpropanes Benzenesulfonyl compounds Indoles and derivatives Pyrrolidinecarboxamides Benzoyl derivatives N-acylpyrrolidines Thiophenol ethers Phenols Chlorobenzenes Alkylarylthioethers Aryl chlorides Aminosulfonyl compounds Tertiary carboxylic acid amides Organosulfonic acids and derivatives Alpha-haloketones Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzenesulfonamide - Indole or derivatives - Benzenesulfonyl group - Phenylpropane - Benzamide - Benzoic acid or derivatives - N-acylpyrrolidine - Aryl thioether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Benzoyl - Thiophenol ether - Halobenzene - Phenol - Chlorobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Alpha-haloketone - Tertiary carboxylic acid amide - Aminosulfonyl compound - Secondary carboxylic acid amide - Carboxamide group - Ketone - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organohalogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - 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