Vitas-M small molecule compound
(2Z)-2-(1-benzofuran-2-ylmethylidene)-7-{[benzyl(methyl)ammonio]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK620525
SMILES C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)Cc1ccccc1
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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 C26H21NO4 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO4/c1-27(15-17-7-3-2-4-8-17)16-21-22(28)12-11-20-25(29)24(31-26(20)21)14-19-13-18-9-5-6-10-23(18)30-19/h2-14,28H,15-16H2,1H3/b24-14-InChIKey
CNKOAILMZWONOF-OYKKKHCWSA-NSynonyms
929826-92-6(2Z)2(1benzofuran2ylmethylidene)7((benzyl(methyl)amino)methyl)6hydroxy1benzofuran3one
(2Z)2(1benzofuran2ylmethylidene)7((benzyl(methyl)ammonio)methyl)3oxo23dihydro1benzofuran6olate
929826926
C(NH+)(Cc1c((O))ccc2c1OC(=Cc1cc3c(o1)cccc3)C2=O)Cc1ccccc1
CN(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CC5=CC=CC=C5O4)C3=O)O
InChI=1SC26H21NO4c127(15177324817)162122(28)12112025(29)24(3126(20)21)141913189561023(18)3019h21428H1516H21H3b2414
MFCD09793131
ZINC000020647682
ZINC20647682
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