Vitas-M small molecule compound

methyl 3-{1-[2-(3,4-dihydroxyphenyl)ethyl]-2-hydroxy-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}-3-(quinolin-4-yl)propanoate

Catalog ID
STL548436
SMILES COC(=O)CC(c1ccnc2c1cccc2)c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C

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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 C27H26N2O6 MW 474.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6/c1-16-13-24(32)26(27(34)29(16)12-10-17-7-8-22(30)23(31)14-17)20(15-25(33)35-2)18-9-11-28-21-6-4-3-5-19(18)21/h3-9,11,13-14,20,30-31,34H,10,12,15H2,1-2H3
InChIKey
ZTLMDESQMDXMHX-UHFFFAOYSA-N
Synonyms

InChI=1SC27H26N2O6c1161324(32)26(27(34)29(16)1210177822(30)23(31)1417)20(1525(33)352)189112821643519(18)21h3911131420303134H101215H212H3
methyl3(1(2(34dihydroxyphenyl)ethyl)2hydroxy6methyl4oxo14dihydropyridin3yl)3(quinolin4yl)propanoate
MFCD31756755
ZINC000409414674
ZINC000409414675

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.