Compound Identification
SMILES
CCC1(OC)O[C@@H]2[C@H](CO)O[C@@H]([C@H]2O1)N1C=CC(=O)NC1=O
InChIKey
InChIKey=SEOAQTKTFKHSOS-MWYBHKGESA-N
Formula
C13H18N2O7
Mass
314.294
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
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
Ortho esters Carboxylic acid orthoesters Monosaccharides Hydropyrimidines Vinylogous amides 1,3-dioxolanes Oxolanes Heteroaromatic compounds Ureas Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carboxylic acid orthoester - Ortho ester - Pyrimidone - Hydropyrimidine - Monosaccharide - Meta-dioxolane - Heteroaromatic compound - Oxolane - Vinylogous amide - Lactam - Orthocarboxylic acid derivative - Urea - Oxacycle - Azacycle - Alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Primary alcohol - Aromatic heteropolycyclic 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