Compound Identification
SMILES
CN1CC=C[C+](C1)C(=O)[C@]1(O)C(F)[C@@H](O[C@]1(F)C(O)(F)C(=O)C(C)(C)C)N1C=C(C)C(=O)NC1=O
InChIKey
InChIKey=LDXMAUBSSXUKRI-ANSCBLETSA-O
Formula
C22H27F3N3O7
Mass
502.467
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidones
Alternative Parents
Acyloins Beta-amino ketones Hydropyridines Hydropyrimidines Oxolanes Vinylogous amides Alpha-hydroxy ketones Alpha-haloketones Tertiary alcohols Heteroaromatic compounds Ureas Trialkylamines Lactams Fluorohydrins Oxacyclic compounds Azacyclic compounds Organofluorides Alkyl fluorides Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Acyloin - Beta-aminoketone - Hydropyrimidine - Hydropyridine - Alpha-haloketone - Alpha-hydroxy ketone - Heteroaromatic compound - Oxolane - Vinylogous amide - Tertiary alcohol - Lactam - Ketone - Tertiary aliphatic amine - Tertiary amine - Urea - Halohydrin - Fluorohydrin - Oxacycle - Azacycle - Organic nitrogen compound - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available