Vitas-M small molecule compound
methyl 3-(1,3-benzodioxol-5-yl)-3-{1-[2-(3,4-dihydroxyphenyl)ethyl]-2-hydroxy-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}propanoate
Catalog ID
STL548846
SMILES COC(=O)CC(c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C)c1ccc2c(c1)OCO2
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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 C25H25NO8 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO8/c1-14-9-20(29)24(25(31)26(14)8-7-15-3-5-18(27)19(28)10-15)17(12-23(30)32-2)16-4-6-21-22(11-16)34-13-33-21/h3-6,9-11,17,27-28,31H,7-8,12-13H2,1-2H3InChIKey
SNMCUZAYTZZRPZ-UHFFFAOYSA-NSynonyms
InChI=1SC25H25NO8c114920(29)24(25(31)26(14)87153518(27)19(28)1015)17(1223(30)322)16462122(1116)34133321h3691117272831H781213H212H3
methyl3(13benzodioxol5yl)3(1(2(34dihydroxyphenyl)ethyl)2hydroxy6methyl4oxo14dihydropyridin3yl)propanoate
MFCD31756818
ZINC000409414296
ZINC000409414297
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