Vitas-M small molecule compound
(2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL529960
SMILES CC1Oc2ccccc2C=C1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1C)[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 C26H27NO4 MW 417.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO4/c1-16-7-5-6-12-27(16)15-21-22(28)11-10-20-25(29)24(31-26(20)21)14-19-13-18-8-3-4-9-23(18)30-17(19)2/h3-4,8-11,13-14,16-17,28H,5-7,12,15H2,1-2H3/b24-14-InChIKey
VLNUFZKTWCXVTO-OYKKKHCWSA-NSynonyms
859670-30-7(2Z)2((2methyl2Hchromen3yl)methylidene)7((2methylpiperidinium1yl)methyl)3oxo23dihydro1benzofuran6olate
859670307
MFCD06765907
ZINC000020612016
ZINC000245241976
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