Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(O)C1=NC2=CC=CC=C2O1
InChIKey
InChIKey=KPMRZBLPEPICFE-LHAAODKRSA-N
Formula
C31H38N4O7
Mass
578.666
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
Valine and derivatives Hippuric acids and derivatives Proline and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzoic acid esters Benzoxazoles Benzoyl derivatives Pyrrolidinecarboxamides N-acylpyrrolidines Oxazoles Methyl esters Heteroaromatic compounds Tertiary carboxylic acid amides Secondary alcohols Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Aromatic alcohols Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - Proline or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzoate ester - Benzamide - Benzoic acid or derivatives - Benzoxazole - Benzoyl - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Benzenoid - Monocyclic benzene moiety - Methyl ester - Pyrrolidine - Tertiary carboxylic acid amide - Azole - Oxazole - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Aromatic alcohol - Carbonyl group - Alcohol - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen 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