Compound Identification
SMILES
NC1=NC2=C(N=C(CN2)[C@@H](O)[C@@H]2COP(O)(=O)O2)C(=O)N1
InChIKey
InChIKey=QXDMVWOCXHMTPE-UJURSFKZSA-N
Formula
C9H12N5O6P
Mass
317.198
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pteridines and derivatives
- Subclass Pterins and derivatives
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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
Pyrimidones Aminopyrimidines and derivatives Organic phosphoric acids and derivatives Imidolactams Vinylogous amides Dioxaphospholanes Heteroaromatic compounds Secondary alcohols Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pterin - Aminopyrimidine - Pyrimidone - Organic phosphoric acid derivative - Pyrimidine - Imidolactam - 1,3_dioxaphospholane - Heteroaromatic compound - Vinylogous amide - Ketimine - Lactam - Secondary alcohol - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Amine - Alcohol - Imine - Organic oxygen compound - 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