Vitas-M small molecule compound

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate

Catalog ID
STL515280
SMILES CC1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc2c(c1)OCCO2

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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 C24H25NO5 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO5/c1-15-6-8-25(9-7-15)13-18-20(26)4-3-17-23(27)19(14-30-24(17)18)16-2-5-21-22(12-16)29-11-10-28-21/h2-5,12,14-15,26H,6-11,13H2,1H3
InChIKey
FKFOFVHUXHEKGO-UHFFFAOYSA-N
Synonyms
637751-97-4
3(23dihydro14benzodioxin6yl)8((4methylpiperidinium1yl)methyl)4oxo4Hchromen7olate
44665069
637751974
MFCD04142524
ZINC000019938610

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.