Vitas-M small molecule compound
ethyl 5-{3-[(4-fluorobenzyl)amino]-1-(7-methoxy-1,3-benzodioxol-5-yl)-3-oxopropyl}-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435177
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1cc(OC)c2c(c1)OCO2)CC(=O)NCc1ccc(cc1)F
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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 C26H25FN2O8 MW 512.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN2O8/c1-3-35-26(33)18-12-29-25(32)22(23(18)31)17(10-21(30)28-11-14-4-6-16(27)7-5-14)15-8-19(34-2)24-20(9-15)36-13-37-24/h4-9,12,17H,3,10-11,13H2,1-2H3,(H,28,30)(H2,29,31,32)InChIKey
GFDJVJFJSLOSGC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCC2=CC=C(C=C2)F)C3=CC4=C(C(=C3)OC)OCO4
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1cc(OC)c2c(c1)OCO2)CC(=O)NCc1ccc(cc1)F
ethyl5(3((4fluorobenzyl)amino)1(7methoxy13benzodioxol5yl)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(3((4fluorophenyl)methylamino)1(7methoxy13benzodioxol5yl)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC26H25FN2O8c133526(33)18122925(32)22(23(18)31)17(1021(30)2811144616(27)7514)15819(342)2420(915)36133724h491217H3101113H212H3(H2830)(H2293132)
MFCD30711713
ZINC000253496483
ZINC000253496484
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