Vitas-M small molecule compound
ethyl 4-hydroxy-5-[3-{[2-(1H-indol-3-yl)ethyl]amino}-1-(4-methoxyphenyl)-3-oxopropyl]-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435190
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc(cc1)OC)CC(=O)NCCc1c[nH]c2c1cccc2
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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 C28H29N3O6 MW 503.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O6/c1-3-37-28(35)22-16-31-27(34)25(26(22)33)21(17-8-10-19(36-2)11-9-17)14-24(32)29-13-12-18-15-30-23-7-5-4-6-20(18)23/h4-11,15-16,21,30H,3,12-14H2,1-2H3,(H,29,32)(H2,31,33,34)InChIKey
NXNGQVXVAWWSDV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCCC2=CNC3=CC=CC=C32)C4=CC=C(C=C4)OC
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc(cc1)OC)CC(=O)NCCc1c(nH)c2c1cccc2
ethyl4hydroxy5(3((2(1Hindol3yl)ethyl)amino)1(4methoxyphenyl)3oxopropyl)6oxo16dihydropyridine3carboxylate
ethyl4hydroxy5(3(2(1Hindol3yl)ethylamino)1(4methoxyphenyl)3oxopropyl)6oxo1Hpyridine3carboxylate
InChI=1SC28H29N3O6c133728(35)22163127(34)25(26(22)33)21(1781019(362)11917)1424(32)29131218153023754620(18)23h41115162130H31214H212H3(H2932)(H2313334)
MFCD30711726
ZINC000253496554
ZINC000253496555
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