Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=C(OC(=O)N2CCC3(CC2)C(=O)CCC3=O)C=C1)C(O)=O
InChIKey
InChIKey=DUDUUHFUCPFLLR-DQEYMECFSA-N
Formula
C31H35N3O9S
Mass
625.69
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
-
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
Phenylalanine and derivatives N,N-disubstituted p-toluenesulfonamides N-acyl-L-alpha-amino acids Proline and derivatives Alpha amino acid amides Phenylpropanoic acids Amphetamines and derivatives Azaspirodecane derivatives Benzenesulfonamides Piperidinecarboxylic acids Benzenesulfonyl compounds Phenoxy compounds Pyrrolidinecarboxamides Organosulfonamides Sulfonyls Carbamate esters Secondary carboxylic acid amides Ketones Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - N-acyl-l-alpha-amino acid - Proline or derivatives - N,n-disubstituted p-toluenesulfonamide - Alpha-amino acid amide - P-toluenesulfonamide - 3-phenylpropanoic-acid - Alpha-amino acid or derivatives - Azaspirodecane - Benzenesulfonamide - Amphetamine or derivatives - Tosyl compound - Benzenesulfonyl group - Piperidinecarboxylic acid - Phenoxy compound - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Toluene - Piperidine - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carbamic acid ester - Pyrrolidine - Sulfonyl - Carboxamide group - Ketone - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Carboxylic acid - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organooxygen 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