Vitas-M small molecule compound
methyl 3-{6-[(4-formylpiperazin-1-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoate
Catalog ID
STL549799
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)C=O)cc(=O)c1O)c1cc(OC)c2c(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 C23H26N2O9 MW 474.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O9/c1-30-18-7-14(8-19-23(18)33-13-32-19)16(10-20(28)31-2)22-21(29)17(27)9-15(34-22)11-24-3-5-25(12-26)6-4-24/h7-9,12,16,29H,3-6,10-11,13H2,1-2H3InChIKey
PQWDEYPVXDRHNX-UHFFFAOYSA-NSynonyms
129895689
InChI=1SC23H26N2O9c13018714(81923(18)33133219)16(1020(28)312)2221(29)17(27)915(3422)11243525(1226)6424h79121629H36101113H212H3
methyl3(6((4formylpiperazin1yl)methyl)3hydroxy4oxo4Hpyran2yl)3(7methoxy13benzodioxol5yl)propanoate
methyl3(6((4formylpiperazin1yl)methyl)3hydroxy4oxo4Hpyran2yl)3(7methoxybenzo(d)(13)dioxol5yl)propanoate
methyl3(6((4formylpiperazin1yl)methyl)3hydroxy4oxopyran2yl)3(7methoxy13benzodioxol5yl)propanoate
MFCD31757211
ZINC000524731931
ZINC000524731932
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