Vitas-M small molecule compound
(2Z)-7-[(diethylammonio)methyl]-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK857066
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+](CC)CC)[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 C23H27NO6 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO6/c1-6-24(7-2)13-16-17(25)9-8-15-21(26)18(30-22(15)16)10-14-11-19(27-3)23(29-5)20(12-14)28-4/h8-12,25H,6-7,13H2,1-5H3/b18-10-InChIKey
OZZUFNIIXVLZAK-ZDLGFXPLSA-NSynonyms
869077-21-4(2Z)7((diethylammonio)methyl)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6olate
869077214
CCN(CC)CC1=C(C=CC2=C1OC(=CC3=CC(=C(C(=C3)OC)OC)OC)C2=O)O
COc1cc(C=C2Oc3c(C2=O)ccc(c3C(NH+)(CC)CC)(O))cc(c1OC)OC
InChI=1SC23H27NO6c1624(72)131617(25)981521(26)18(3022(15)16)10141119(273)23(295)20(1214)284h81225H6713H215H3b1810
MFCD06405731
ZINC000020624678
Check stock
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Check stock on Vitas-MAvailable files
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