Compound Identification
SMILES
C[C@@H]([C@H](NC(=O)[C@H](CC[S+](C)[O-])NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)C(=O)N\C=C1\C[C@@H](O)[C@@H](O1)n1ccc(=O)[nH]c1=O)N(C)C(=O)[C@@H](N)Cc1cccc(O)c1
InChIKey
InChIKey=PGJWAEOEBLIGSQ-APPOVVRKSA-N
Formula
C40H49N9O12S
Mass
879.94
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
Phenylalanine and derivatives N-acyl-alpha amino acids and derivatives N-carbamoyl-alpha amino acids Indolyl carboxylic acids and derivatives Alpha amino acid amides Amphetamines and derivatives 3-alkylindoles 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Pyrimidones 1-hydroxy-4-unsubstituted benzenoids N-acyl amines Hydropyrimidines Substituted pyrroles Heteroaromatic compounds Tertiary carboxylic acid amides Vinylogous amides Tetrahydrofurans Ureas Sulfoxides Secondary carboxylic acid amides Amino acids Secondary alcohols Lactams Carboxylic acids Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Sulfinyl compounds Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - N-carbamoyl-alpha-amino acid - N-carbamoyl-alpha-amino acid or derivatives - Alpha-amino acid amide - Indolyl carboxylic acid derivative - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - 3-alkylindole - Indole - Indole or derivatives - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidone - Aralkylamine - Hydropyrimidine - Fatty amide - N-acyl-amine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Substituted pyrrole - Fatty acyl - Heteroaromatic compound - Tetrahydrofuran - Tertiary carboxylic acid amide - Vinylogous amide - Pyrrole - Lactam - Amino acid - Amino acid or derivatives - Carbonic acid derivative - Carboxamide group - Urea - Sulfoxide - Secondary carboxylic acid amide - Secondary alcohol - Sulfinyl compound - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Alcohol - Primary amine - Amine - 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