Vitas-M small molecule compound
methyl 3-(4-hydroxy-2-oxo-2H-pyrido[1,2-a]pyrimidin-3-yl)-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate
Catalog ID
STL540800
SMILES COC(=O)CC(c1c(=O)nc2n(c1O)cccc2)c1cc(OC)c2c(c1)OCCO2
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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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-27-14-9-12(10-15-19(14)30-8-7-29-15)13(11-17(24)28-2)18-20(25)22-16-5-3-4-6-23(16)21(18)26/h3-6,9-10,13,26H,7-8,11H2,1-2H3InChIKey
QJIPTPNBZMVISD-UHFFFAOYSA-NSynonyms
InChI=1SC21H20N2O7c12714912(101519(14)30872915)13(1117(24)282)1820(25)2216534623(16)21(18)26h369101326H7811H212H3
methyl3(4hydroxy2oxo2Hpyrido(12a)pyrimidin3yl)3(8methoxy23dihydro14benzodioxin6yl)propanoate
MFCD31755187
ZINC000205948070
ZINC000205948086
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