Compound Identification
SMILES
CSCCC(NC(=O)NC(CC1=CNC2=CC=CC=C12)C(O)=O)C(=O)NC(C(C)N(C)C(=O)C(CC1=CC(O)=CC=C1)NC(=O)OCC1=CC=CC=C1)C(=O)N\C=C1/C[C@@H](O)[C@@H](O1)N1C=CC(=O)NC1=O
InChIKey
InChIKey=UNSHUAWSNKEDPX-MLZZJALQSA-N
Formula
C48H55N9O13S
Mass
998.08
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
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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
Phenylalanine and derivatives Methionine and derivatives N-acyl-alpha amino acids and derivatives N-carbamoyl-alpha amino acids Indolyl carboxylic acids and derivatives Alpha amino acid amides Benzyloxycarbonyls Amphetamines and derivatives 3-alkylindoles 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Pyrimidones Substituted pyrroles Hydropyrimidines N-acyl amines Carbamate esters Tertiary carboxylic acid amides Tetrahydrofurans Heteroaromatic compounds Vinylogous amides Ureas Lactams Secondary alcohols Secondary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - Methionine or derivatives - N-carbamoyl-alpha-amino acid or derivatives - N-carbamoyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Indolyl carboxylic acid derivative - Amphetamine or derivatives - Benzyloxycarbonyl - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidone - N-acyl-amine - Pyrimidine - Substituted pyrrole - Benzenoid - Fatty acyl - Hydropyrimidine - Fatty amide - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Tetrahydrofuran - Tertiary carboxylic acid amide - Pyrrole - Secondary alcohol - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxamide group - Urea - Lactam - Thioether - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Monocarboxylic acid or derivatives - Sulfenyl compound - Organooxygen compound - Carbonyl group - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - 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