Compound Identification
SMILES
O=C1COC(=O)C1=C1C(=O)NC(=O)NC1=O
InChIKey
InChIKey=GWMKPMNCTOIDCN-UHFFFAOYSA-N
Formula
C8H4N2O6
Mass
224.128
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidones
- Level 6 Barbituric acid derivatives
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Level 5
Pyrimidones
-
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
Pyrimidones
Direct Parent
Barbituric acid derivatives
Alternative Parents
N-acyl ureas Gamma butyrolactones Furanones Diazinanes Tetrahydrofurans Enoate esters Dicarboximides Cyclic ketones Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Barbiturate - N-acyl urea - Ureide - 1,3-diazinane - 3-furanone - Gamma butyrolactone - Dicarboximide - Tetrahydrofuran - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Cyclic ketone - Carboxylic acid ester - Ketone - Lactone - Carbonic acid derivative - Urea - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.
External Descriptors
Not available