Vitas-M small molecule compound
1-benzyl-5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
Catalog ID
STL525529
SMILES COc1c(OC)ccc2c1C(=O)OC2c1c(=O)[nH]c(=O)n(c1O)Cc1ccccc1
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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 C21H18N2O7 MW 410.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O7/c1-28-13-9-8-12-14(17(13)29-2)20(26)30-16(12)15-18(24)22-21(27)23(19(15)25)10-11-6-4-3-5-7-11/h3-9,16,25H,10H2,1-2H3,(H,22,24,27)InChIKey
LUYBGRYMOONBTC-UHFFFAOYSA-NSynonyms
491606-65-61benzyl5(45dimethoxy3oxo1~(H)2benzofuran1yl)6hydroxypyrimidine24dione
1benzyl5(45dimethoxy3oxo13dihydro2benzofuran1yl)6hydroxypyrimidine24(1H3H)dione
1BENZYL5(45DIMETHOXY3OXO13DIHYDROISOBENZOFURAN1YL)6HYDROXYPYRIMIDINE24(1H3H)DIONE
1BENZYL5(45DIMETHOXY3OXO1H2BENZOFURAN1YL)6HYDROXYPYRIMIDINE24DIONE
3725394
491606656
COc1c(OC)ccc2c1C(=O)OC2c1c(=O)(nH)c(=O)n(c1O)Cc1ccccc1
InChI=1SC21H18N2O7c12813981214(17(13)292)20(26)3016(12)1518(24)2221(27)23(19(15)25)10116435711h391625H10H212H3(H222427)
MFCD02056731
ZINC000004027379
ZINC000004027380
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