Compound Identification
SMILES
CCOC(=O)N1C=NC=C1CC(NC(=O)CC1=C(NC2=CC=CC=C12)C(=O)C=C(C)C)C(=O)OC
InChIKey
InChIKey=PUABESCNNBSDMO-UHFFFAOYSA-N
Formula
C25H28N4O6
Mass
480.521
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Histidine and derivatives
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Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Histidine and derivatives
Alternative Parents
Alpha amino acid esters N-acyl-alpha amino acids and derivatives 3-alkylindoles Aryl ketones Carbonylimidazoles Fatty acid esters Substituted pyrroles Benzenoids N-substituted imidazoles Acryloyl compounds Methyl esters Enones Heteroaromatic compounds Secondary carboxylic acid amides Organic carbonic acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Histidine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - 3-alkylindole - Indole or derivatives - Indole - Aryl ketone - Imidazole-1-carbonyl group - Fatty acid ester - N-substituted imidazole - Fatty acyl - Substituted pyrrole - Benzenoid - Acryloyl-group - Azole - Heteroaromatic compound - Imidazole - Pyrrole - Alpha,beta-unsaturated ketone - Methyl ester - Enone - Ketone - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as histidine and derivatives. These are compounds containing cysteine or a derivative thereof resulting from reaction of cysteine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available