Vitas-M small molecule compound

(2Z)-7-[(dipropylammonio)methyl]-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate

Catalog ID
STK630812
SMILES CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)OC)/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 C23H27NO4 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO4/c1-4-11-24(12-5-2)15-19-20(25)10-9-18-22(26)21(28-23(18)19)14-16-7-6-8-17(13-16)27-3/h6-10,13-14,25H,4-5,11-12,15H2,1-3H3/b21-14-
InChIKey
JQJHXIVTZQTJJO-STZFKDTASA-N
Synonyms
929456-81-5
(2Z)7((dipropylammonio)methyl)2(3methoxybenzylidene)3oxo23dihydro1benzofuran6olate
7((DIPROPYLAMINO)METHYL)6HYDROXY2((3METHOXYPHENYL)METHYLENE)BENZO(B)FURAN3ONE
CCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cccc(c1)OC)C2=O)CCC
MFCD09792659
ZINC000020648353
ZINC20648353

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Available files

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