Compound Identification
SMILES
CC1=CN([C@H]2C[C@H](O)[C@H](O2)C(O)N(CCC(O)=O)CCC(O)=O)C(=O)NC1=O
InChIKey
InChIKey=KVEDGKLOVFPIDB-KPIFTKLCSA-N
Formula
C16H23N3O9
Mass
401.372
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Dicarboxylic acids and derivatives Hydropyrimidines Oxolanes Heteroaromatic compounds Vinylogous amides Tertiary amines Secondary alcohols Lactams Hemiaminals Amino acids Ureas Oxacyclic compounds Azacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Dicarboxylic acid or derivatives - Hydropyrimidine - Heteroaromatic compound - Oxolane - Vinylogous amide - Amino acid or derivatives - Hemiaminal - Amino acid - Lactam - Urea - Tertiary amine - Secondary alcohol - Alkanolamine - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organic oxide - Organic oxygen compound - Amine - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - 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