Compound Identification
SMILES
[Na+].NC1=NC(=O)C2=C(N1)N(CC(CO)CC(C1=CC=CC=C1)P(O)([O-])=O)C=N2
InChIKey
InChIKey=OVWPDPICQUNEDT-UHFFFAOYSA-M
Formula
C16H19N5NaO5P
Mass
415.322
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
6-oxopurines Hypoxanthines Pyrimidones Aminopyrimidines and derivatives N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Organic phosphonic acids Azacyclic compounds Organic oxides Organic sodium salts Hydrocarbon derivatives Organic zwitterions Organophosphorus compounds Primary alcohols Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Purine - Aminopyrimidine - Pyrimidone - N-substituted imidazole - Pyrimidine - Azole - Heteroaromatic compound - Imidazole - Organophosphonic acid - Vinylogous amide - Organophosphonic acid derivative - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic salt - Amine - Organic sodium salt - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic zwitterion - Primary alcohol - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available