Vitas-M small molecule compound
2-{5-[1-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-methoxy-3-oxopropyl]furan-2-yl}benzoic acid
Catalog ID
STL547168
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1ccc(o1)c1ccccc1C(=O)O
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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 C32H32N2O9 MW 588.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2O9/c1-40-21-9-7-20(8-10-21)34-15-13-33(14-16-34)19-22-17-26(35)30(37)31(42-22)25(18-29(36)41-2)28-12-11-27(43-28)23-5-3-4-6-24(23)32(38)39/h3-12,17,25,37H,13-16,18-19H2,1-2H3,(H,38,39)InChIKey
DFIVVTIHYVNSBX-UHFFFAOYSA-NSynonyms
110206544
2(5(1(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
2(5(1(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
InChI=1SC32H32N2O9c140219720(81021)34151333(141634)19221726(35)30(37)31(4222)25(1829(36)412)28121127(4328)23534624(23)32(38)39h312172537H13161819H212H3(H3839)
MFCD29055744
ZINC000253399692
ZINC000253399698
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