Vitas-M small molecule compound

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

Catalog ID
STL548882
SMILES COC(=O)CC(c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C)c1coc2c(c1=O)cc(cc2)Cl

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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 C27H24ClNO8 MW 525.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClNO8/c1-14-9-22(32)25(27(35)29(14)8-7-15-3-5-20(30)21(31)10-15)17(12-24(33)36-2)19-13-37-23-6-4-16(28)11-18(23)26(19)34/h3-6,9-11,13,17,30-31,35H,7-8,12H2,1-2H3
InChIKey
DUURRHNCIGOENN-UHFFFAOYSA-N
Synonyms

InChI=1SC27H24ClNO8c114922(32)25(27(35)29(14)87153520(30)21(31)1015)17(1224(33)362)191337236416(28)1118(23)26(19)34h369111317303135H7812H212H3
methyl3(6chloro4oxo4Hchromen3yl)3(1(2(34dihydroxyphenyl)ethyl)2hydroxy6methyl4oxo14dihydropyridin3yl)propanoate
MFCD31756825
ZINC000409413452
ZINC000409413456

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Available files

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