Vitas-M small molecule compound
(2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-methyl-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK613219
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1ccc(c(c1OC)OC)OC)/C2=O)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 C26H32N2O7 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O7/c1-16-13-19(30)18(15-28-9-7-27(8-10-28)11-12-29)25-22(16)23(31)21(35-25)14-17-5-6-20(32-2)26(34-4)24(17)33-3/h5-6,13-14,29-30H,7-12,15H2,1-4H3/b21-14-InChIKey
ZATPSMLFEYXUEQ-STZFKDTASA-NSynonyms
903859-11-0(2Z)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)4methyl3oxo2(234trimethoxybenzylidene)23dihydro1benzofuran6olate
6HYDROXY7((4(2HYDROXYETHYL)1PIPERAZINYL)METHYL)4METHYL2(234TRIMETHOXYBENZYLIDENE)1BENZOFURAN3(2H)ONE
6HYDROXY7((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)4METHYL2((234TRIMETHOXYPHENYL)METHYLENE)BENZO(B)FURAN3ONE
MFCD08290269
OCCN1CC(NH+)(CC1)Cc1c((O))cc(c2c1OC(=Cc1ccc(c(c1OC)OC)OC)C2=O)C
ZINC000020589622
ZINC20589622
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