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-(5-phenylfuran-2-yl)propanoate
Catalog ID
STL547524
SMILES COC(=O)CC(c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C)c1ccc(o1)c1ccccc1
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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 C28H27NO7 MW 489.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO7/c1-17-14-23(32)27(28(34)29(17)13-12-18-8-9-21(30)22(31)15-18)20(16-26(33)35-2)25-11-10-24(36-25)19-6-4-3-5-7-19/h3-11,14-15,20,30-31,34H,12-13,16H2,1-2H3InChIKey
AYFOLIIVAYZUDE-UHFFFAOYSA-NSynonyms
InChI=1SC28H27NO7c1171423(32)27(28(34)29(17)1312188921(30)22(31)1518)20(1626(33)352)25111024(3625)196435719h311141520303134H121316H212H3
methyl3(1(2(34dihydroxyphenyl)ethyl)2hydroxy6methyl4oxo14dihydropyridin3yl)3(5phenylfuran2yl)propanoate
MFCD31756586
ZINC000409413356
ZINC000409413357
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