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Oxonic acid-[13C2,15N3] Potassium salt Hydrate

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General Information
Catalog: BLP-007846
Molecular Formula: C2[13C]2H2[15N]3KO4.H2O
Molecular Weight: 218.16

Chemical Structure

Description	Oxonic acid-[13C2,15N3] potassium salt hydrate is the labelled salt hydrate of Oxonic acid, which is an antitumor effect potentiator and antitumor agent.
Synonyms	1,4,5,6-Tetrahydro-4,6-dioxo-1,3,5-triazine-2-carboxylic Acid-13C2,15N3 Potassium Salt Hydrate; Oxonic acid-13C2,15N3 potassium salt Hydrate; Triazine-2,4-dione-6-carboxylic Acid-13C2,15N3 Potassium Salt Hydrate; 5-Azaorotic Acid-13C2,15N3 Potassium Salt Hydrate; Oteracil-13C2,15N3 Potassium Salt Hydrate
IUPAC Name	potassium;4,6-dioxo-(4,6-13C2,1,3,5-15N3)1H-1,3,5-triazine-2-carboxylate;hydrate
Related CAS	855926-53-3 (anhydrous) 2207-75-2 (unlabelled anhydrous)
Canonical SMILES	C1(=NC(=O)NC(=O)N1)C(=O)[O-].O.[K+]
InChI	InChI=1S/C4H3N3O4.K.H2O/c8-2(9)1-5-3(10)7-4(11)6-1;;/h(H,8,9)(H2,5,6,7,10,11);;1H2/q;+1;/p-1/i3+1,4+1,5+1,6+1,7+1;;
InChI Key	KAISPCXZDYMVOB-YKHLTIOGSA-M
Melting Point	>250°C (dec.)
Purity	95%
Solubility	Slightly soluble in Methanol, Water
Appearance	Pale Beige to Beige Solid
Storage	Store at -20°C