Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=C(C=C1)C(=O)NCC#CC1=CN(C2CC(O)C(OOP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)C(=O)N=C1N

InChIKey

InChIKey=KSPKKGUOXKIXQP-UHFFFAOYSA-N

Formula

C20H23N4O16P3

Mass

668.337

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Acetophenone - Benzamide - Benzoic acid or derivatives - Benzoyl - Aryl alkyl ketone - Aminopyrimidine - Pyrimidone - Hydropyrimidine - Organic phosphoric acid derivative - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Imidolactam - Heteroaromatic compound - Oxolane - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Amine - Primary amine - Organonitrogen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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