Vitas-M small molecule compound
(2Z)-2-(2,4-dimethoxybenzylidene)-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK856647
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCC(CC1)C)[O-]
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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 C24H27NO5 MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5/c1-15-8-10-25(11-9-15)14-19-20(26)7-6-18-23(27)22(30-24(18)19)12-16-4-5-17(28-2)13-21(16)29-3/h4-7,12-13,15,26H,8-11,14H2,1-3H3/b22-12-InChIKey
OUDWCQGYNVLRIJ-UUYOSTAYSA-NSynonyms
869078-02-4(2Z)2(24dimethoxybenzylidene)7((4methylpiperidinium1yl)methyl)3oxo23dihydro1benzofuran6olate
869078024
CC1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=C(C=C(C=C4)OC)OC)C3=O)O
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2C(NH+)1CCC(CC1)C)(O)
InChI=1SC24H27NO5c11581025(11915)141920(26)761823(27)22(3024(18)19)12164517(282)1321(16)293h4712131526H81114H213H3b2212
MFCD06405771
ZINC000013653743
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