Vitas-M small molecule compound

methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-[3-(hydroxymethyl)-4-methoxyphenyl]propanoate

Catalog ID
STL546967
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1ccc(c(c1)CO)OC

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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 C29H34N2O8 MW 538.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O8/c1-36-22-7-5-21(6-8-22)31-12-10-30(11-13-31)17-23-15-25(33)28(35)29(39-23)24(16-27(34)38-3)19-4-9-26(37-2)20(14-19)18-32/h4-9,14-15,24,32,35H,10-13,16-18H2,1-3H3
InChIKey
AMKGHABAPWUNBP-UHFFFAOYSA-N
Synonyms

110207152
InChI=1SC29H34N2O8c136227521(6822)31121030(111331)17231525(33)28(35)29(3923)24(1627(34)383)194926(372)20(1419)1832h491415243235H10131618H213H3
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(3(hydroxymethyl)4methoxyphenyl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3(3(hydroxymethyl)4methoxyphenyl)propanoate
MFCD29056022
ZINC000253395581
ZINC000253395582

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Available files

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