Compound Identification
SMILES
CSCC[C@H](NC(=O)[C@H](CC1=CC=C(OS(O)(=O)=O)C=C1)NC(C)=O)C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
InChIKey
InChIKey=PWXYNAYCEZERPA-BGBFCPIGSA-N
Formula
C47H60N10O13S3
Mass
1069.23
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 Oligopeptides
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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
Oligopeptides
Alternative Parents
Phenylalanine and derivatives Asparagine and derivatives Methionine and derivatives N-acyl-alpha amino acids and derivatives Tryptamines and derivatives Alpha amino acid amides Phenylsulfates 3-alkylindoles Amphetamines and derivatives Phenoxy compounds Sulfuric acid monoesters Substituted pyrroles N-acyl amines Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Dialkylthioethers Carbonyl compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-oligopeptide - Phenylalanine or derivatives - Asparagine or derivatives - Methionine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Triptan - Phenylsulfate - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Arylsulfate - Amphetamine or derivatives - 3-alkylindole - Indole - Indole or derivatives - Phenoxy compound - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Substituted pyrrole - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Benzenoid - Pyrrole - Heteroaromatic compound - Acetamide - Organic sulfuric acid or derivatives - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - Dialkylthioether - Sulfenyl compound - Organoheterocyclic compound - Thioether - Azacycle - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
External Descriptors
Not available