Vitas-M small molecule compound
(2Z)-2-(1-benzofuran-2-ylmethylidene)-7-[(diethylammonio)methyl]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK856274
SMILES CC[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)C)CC
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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 C23H23NO4 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4/c1-4-24(5-2)13-17-18(25)10-14(3)21-22(26)20(28-23(17)21)12-16-11-15-8-6-7-9-19(15)27-16/h6-12,25H,4-5,13H2,1-3H3/b20-12-InChIKey
GUMGBGZMHJHEBG-NDENLUEZSA-NSynonyms
929832-01-9(2Z)2(1benzofuran2ylmethylidene)7((diethylammonio)methyl)4methyl3oxo23dihydro1benzofuran6olate
(2Z)2(1benzofuran2ylmethylidene)7(diethylaminomethyl)6hydroxy4methyl1benzofuran3one
2(BENZO(D)FURAN2YLMETHYLENE)7((DIETHYLAMINO)METHYL)6HYDROXY4METHYLBENZO(B)FURAN3ONE
929832019
CC(NH+)(Cc1c((O))cc(c2c1OC(=Cc1cc3c(o1)cccc3)C2=O)C)CC
CCN(CC)CC1=C(C=C(C2=C1OC(=CC3=CC4=CC=CC=C4O3)C2=O)C)O
InChI=1SC23H23NO4c1424(52)131718(25)1014(3)2122(26)20(2823(17)21)12161115867919(15)2716h61225H4513H213H3b2012
MFCD09796835
ZINC000020649926
ZINC20649926
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