Compound Identification
SMILES
COC(=O)C1=CC=C(C=CC2=CN=C3NC(NC(C)=O)=NC(=O)C3=N2)C=C1
InChIKey
InChIKey=CDRIXUUJIHHDMW-UHFFFAOYSA-N
Formula
C18H15N5O4
Mass
365.349
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pteridines and derivatives
- Subclass Pterins and derivatives
-
Class
Pteridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Pterins and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pterins and derivatives
Alternative Parents
Benzoic acid esters N-acetylarylamines Styrenes Benzoyl derivatives Pyrimidones Pyrazines Vinylogous amides Methyl esters Heteroaromatic compounds Acetamides Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pterin - Benzoate ester - Benzoic acid or derivatives - N-acetylarylamine - Benzoyl - Styrene - N-arylamide - Pyrimidone - Monocyclic benzene moiety - Pyrazine - Pyrimidine - Benzenoid - Heteroaromatic compound - Acetamide - Vinylogous amide - Methyl ester - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.
External Descriptors
Not available