Vitas-M small molecule compound
(2E)-2-(1-benzofuran-2-ylmethylidene)-7-{[bis(2-methoxyethyl)ammonio]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK629205
SMILES COCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cc3c(o1)cccc3)/C2=O)CCOC
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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 C24H25NO6 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO6/c1-28-11-9-25(10-12-29-2)15-19-20(26)8-7-18-23(27)22(31-24(18)19)14-17-13-16-5-3-4-6-21(16)30-17/h3-8,13-14,26H,9-12,15H2,1-2H3/b22-14+InChIKey
MMGGDZRDAJGORA-HYARGMPZSA-NSynonyms
929836-04-4(2E)2(1benzofuran2ylmethylidene)7((bis(2methoxyethyl)ammonio)methyl)3oxo23dihydro1benzofuran6olate
(2E)2(1benzofuran2ylmethylidene)7((bis(2methoxyethyl)azaniumyl)methyl)3oxo1benzofuran6olate
929836044
COCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cc3c(o1)cccc3)C2=O)CCOC
COCC(NH+)(CCOC)CC1=C(C=CC2=C1OC(=CC3=CC4=CC=CC=C4O3)C2=O)(O)
InChI=1SC24H25NO6c12811925(1012292)151920(26)871823(27)22(3124(18)19)14171316534621(16)3017h38131426H91215H212H3b2214+
MFCD09790954
ZINC000020650234
ZINC20650234
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