Vitas-M small molecule compound

3-(3,4-dimethoxyphenyl)-2-(ethoxycarbonyl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate

Catalog ID
STL514262
SMILES CCOC(=O)c1oc2c(C[NH+]3CCN(CC3)C)c([O-])ccc2c(=O)c1c1ccc(c(c1)OC)OC

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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 C26H30N2O7 MW 482.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O7/c1-5-34-26(31)25-22(16-6-9-20(32-3)21(14-16)33-4)23(30)17-7-8-19(29)18(24(17)35-25)15-28-12-10-27(2)11-13-28/h6-9,14,29H,5,10-13,15H2,1-4H3
InChIKey
YZVGBXXHBXAQQK-UHFFFAOYSA-N
Synonyms
637746-85-1
1427275
3(34dimethoxyphenyl)2(ethoxycarbonyl)8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
637746851
MFCD03660490
ZINC000020114046

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Available files

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