Vitas-M small molecule compound
(2Z)-2-(2,3-dimethoxybenzylidene)-3-oxo-7-(piperidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL515297
SMILES COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1)[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 C23H25NO5 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5/c1-27-19-8-6-7-15(22(19)28-2)13-20-21(26)16-9-10-18(25)17(23(16)29-20)14-24-11-4-3-5-12-24/h6-10,13,25H,3-5,11-12,14H2,1-2H3/b20-13-InChIKey
NHSHWZKPAMCNTE-MOSHPQCFSA-NSynonyms
859661-43-1(2~(Z))2((23dimethoxyphenyl)methylidene)3oxo7(piperidin1ium1ylmethyl)1benzofuran6olate
(2Z)2(23dimethoxybenzylidene)3oxo7(piperidinium1ylmethyl)23dihydro1benzofuran6olate
29094070
859661431
MFCD06494437
ZINC000020611187
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