Vitas-M small molecule compound
(2Z)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK619735
SMILES CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O)CCC
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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 C24H26BrNO5 MW 488.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26BrNO5/c1-3-7-26(8-4-2)12-19-20(27)6-5-18-22(28)21(31-24(18)19)11-15-9-17(25)10-16-13-29-14-30-23(15)16/h5-6,9-11,27H,3-4,7-8,12-14H2,1-2H3/b21-11-InChIKey
JEIOHZODTPVFGY-NHDPSOOVSA-NSynonyms
929434-20-8(2Z)2((6bromo4H13benzodioxin8yl)methylidene)7((dipropylammonio)methyl)3oxo23dihydro1benzofuran6olate
7((DIPROPYLAMINO)METHYL)2((6BROMO(2H4HBENZO(E)13DIOXAN8YL))METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
CCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cc(Br)cc3c1OCOC3)C2=O)CCC
MFCD09796567
ZINC000020650778
ZINC20650778
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