Vitas-M small molecule compound
(2Z)-7-{[bis(2-methylpropyl)ammonio]methyl}-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK629280
SMILES CC(C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)C)/C2=O)CC(C)C)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 C25H31NO3 MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO3/c1-16(2)13-26(14-17(3)4)15-21-22(27)10-9-20-24(28)23(29-25(20)21)12-19-8-6-7-18(5)11-19/h6-12,16-17,27H,13-15H2,1-5H3/b23-12-InChIKey
GQVKCXQMGXXIBL-FMCGGJTJSA-NSynonyms
929823-39-2929823392
CC(C(NH+)(Cc1c((O))ccc2c1OC(=Cc1cccc(c1)C)C2=O)CC(C)C)C
MFCD09798292
ZINC000008991258
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