Compound Identification
SMILES
CC(=O)N[C@@H](CCCCNC(=O)CCCCC1SC[C@H]2NC(=O)N[C@@H]12)C(=O)N[C@@H](CC1=CC([125I])=C(O)C=C1)C(=O)NCCCCCC(=O)N[C@@H](CC(O)=O)C(=O)COC(=O)C1=C(C)C=CC=C1C
InChIKey
InChIKey=NAJRKEXSQCTAGG-BLJVSLMFSA-N
Formula
C47H64IN7O12S
Mass
1076.03
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
Tyrosine and derivatives Biotin and derivatives Phenylalanine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Beta amino acids and derivatives Amphetamines and derivatives Benzoic acid esters m-Xylenes Thienoimidazolidines Benzoyl derivatives Gamma-keto acids and derivatives O-iodophenols 1-hydroxy-2-unsubstituted benzenoids Iodobenzenes Monosaccharides Imidazolidinones N-acyl amines Dicarboxylic acids and derivatives Aryl iodides Acetamides Thiophenes Thiolanes Ketones Ureas Carboxylic acid esters Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Organoiodides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Biotin_derivative - Tyrosine or derivatives - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Beta amino acid or derivatives - Benzoate ester - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzoic acid or derivatives - 2-iodophenol - Gamma-keto acid - Benzoyl - 2-halophenol - Thienoimidazolidine - Xylene - M-xylene - Iodobenzene - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Phenol - Keto acid - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Aryl iodide - Aryl halide - N-acyl-amine - Monosaccharide - Imidazolidinone - Monocyclic benzene moiety - Benzenoid - Acetamide - Imidazolidine - Thiophene - Thiolane - Urea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carbonic acid derivative - Ketone - Thioether - Dialkylthioether - Organoheterocyclic compound - Azacycle - Carboxylic acid - Organic oxide - Organopnictogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Hydrocarbon derivative - 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