Vitas-M small molecule compound
methyl 3-{6-[(4-formylpiperazin-1-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}-3-(6-methoxy-4-oxo-4H-chromen-3-yl)propanoate
Catalog ID
STL551476
SMILES O=CN1CCN(CC1)Cc1cc(=O)c(c(o1)C(c1coc2c(c1=O)cc(cc2)OC)CC(=O)OC)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 C25H26N2O9 MW 498.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O9/c1-33-15-3-4-21-18(9-15)23(31)19(13-35-21)17(11-22(30)34-2)25-24(32)20(29)10-16(36-25)12-26-5-7-27(14-28)8-6-26/h3-4,9-10,13-14,17,32H,5-8,11-12H2,1-2H3InChIKey
VALMXCSVKDOZMH-UHFFFAOYSA-NSynonyms
129894685
InChI=1SC25H26N2O9c13315342118(915)23(31)19(133521)17(1122(30)342)2524(32)20(29)1016(3625)12265727(1428)8626h3491013141732H581112H212H3
methyl3(6((4formylpiperazin1yl)methyl)3hydroxy4oxo4Hpyran2yl)3(6methoxy4oxo4Hchromen3yl)propanoate
methyl3(6((4formylpiperazin1yl)methyl)3hydroxy4oxopyran2yl)3(6methoxy4oxochromen3yl)propanoate
MFCD31758159
ZINC000524729463
ZINC000524729464
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