Vitas-M small molecule compound
(2Z)-7-{[bis(2-methylpropyl)ammonio]methyl}-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK626822
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+](CC(C)C)CC(C)C)[O-])cc(c1OC)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 C27H35NO6 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO6/c1-16(2)13-28(14-17(3)4)15-20-21(29)9-8-19-25(30)22(34-26(19)20)10-18-11-23(31-5)27(33-7)24(12-18)32-6/h8-12,16-17,29H,13-15H2,1-7H3/b22-10-InChIKey
YGUBUMAEEUALAD-YVNNLAQVSA-NSynonyms
929488-42-6(2Z)7((bis(2methylpropyl)ammonio)methyl)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6olate
7((BIS(2METHYLPROPYL)AMINO)METHYL)6HYDROXY2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(B)FURAN3ONE
COc1cc(C=C2Oc3c(C2=O)ccc(c3C(NH+)(CC(C)C)CC(C)C)(O))cc(c1OC)OC
MFCD06692071
ZINC000020646966
ZINC20646966
Check stock
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Check stock on Vitas-MAvailable files
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