Vitas-M small molecule compound
4-ethyl-7-methyl-6-[(3-methylpiperidinium-1-yl)methyl]-2-oxo-2H-chromen-5-olate
Catalog ID
STL044337
SMILES CCc1cc(=O)oc2c1c([O-])c(c(c2)C)C[NH+]1CCCC(C1)C
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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 C19H25NO3 MW 315.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25NO3/c1-4-14-9-17(21)23-16-8-13(3)15(19(22)18(14)16)11-20-7-5-6-12(2)10-20/h8-9,12,22H,4-7,10-11H2,1-3H3InChIKey
FOOAKAQZEAOZQZ-UHFFFAOYSA-NSynonyms
586985-62-84ETHYL5HYDROXY7METHYL6((3METHYLPIPERIDIN1YL)METHYL)CHROMEN2ONE
4ETHYL7METHYL6((3METHYLPIPERIDIN1IUM1YL)METHYL)2OXOCHROMEN5OLATE
4ethyl7methyl6((3methylpiperidinium1yl)methyl)2oxo2Hchromen5olate
586985628
CCC1=CC(=O)OC2=C1C(=C(C(=C2)C)C(NH+)3CCCC(C3)C)(O)
CCc1cc(=O)oc2c1c((O))c(c(c2)C)C(NH+)1CCCC(C1)C
InChI=1SC19H25NO3c1414917(21)2316813(3)15(19(22)18(14)16)112075612(2)1020h891222H471011H213H3
MFCD04031933
ZINC000005112351
ZINC000005112356
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