Vitas-M small molecule compound
2,5,6-trihydroxy-5-[2-(4-methoxyphenyl)-2-oxoethyl]pyrimidin-4(5H)-one
Catalog ID
STK626511
SMILES COc1ccc(cc1)C(=O)CC1(O)C(=NC(=NC1=O)O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H12N2O6 MW 292.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O6/c1-21-8-4-2-7(3-5-8)9(16)6-13(20)10(17)14-12(19)15-11(13)18/h2-5,20H,6H2,1H3,(H2,14,15,17,18,19)InChIKey
NYMLUNFPRGMRNW-UHFFFAOYSA-NSynonyms
861573-11-7256trihydroxy5(2(4methoxyphenyl)2oxoethyl)pyrimidin4(5H)one
5hydroxy5(2(4methoxyphenyl)2oxoethyl)13diazinane246trione
861573117
COC1=CC=C(C=C1)C(=O)CC2(C(=O)NC(=O)NC2=O)O
InChI=1SC13H12N2O6c1218427(358)9(16)613(20)10(17)1412(19)1511(13)18h2520H6H21H3(H21415171819)
MFCD09793794
ZINC000009420321
ZINC9420321
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