Compound Identification
SMILES
CC(C)[C@H](NC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C1=CC(=C(Cl)C=C1)S(=O)(=O)NC(=O)CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F
InChIKey
InChIKey=AAKAOLFCSQWIHU-KZEXPDIDSA-N
Formula
C50H63ClF3N5O11S2
Mass
1066.64
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
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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
Valine and derivatives Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides 4-halobenzoic acids and derivatives Benzenesulfonamides Phenylacetamides Phenylpropanes Benzenesulfonyl compounds Indoles and derivatives Benzoyl derivatives Pyrrolidinecarboxamides N-acylpyrrolidines Phenols Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Aminosulfonyl compounds Alpha-haloketones Organosulfonic acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organofluorides Organonitrogen compounds Alkyl fluorides Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Hippuric acid or derivatives - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Phenylacetamide - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Alpha-amino acid or derivatives - Benzenesulfonyl group - Indole or derivatives - Benzamide - Benzoic acid or derivatives - Phenylpropane - N-acylpyrrolidine - Pyrrolidine-2-carboxamide - Benzoyl - Pyrrolidine carboxylic acid or derivatives - Halobenzene - Chlorobenzene - Phenol - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Alpha-haloketone - Organosulfonic acid or derivatives - Pyrrolidine - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Ketone - Organoheterocyclic compound - Azacycle - Organofluoride - Organonitrogen compound - Alkyl halide - Carbonyl group - Organooxygen compound - Organosulfur compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - 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