Vitas-M small molecule compound
(2Z)-2-(3,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK923874
SMILES COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
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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 C25H18O8 MW 446.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18O8/c1-28-18-7-3-14(9-21(18)29-2)10-23-24(26)17-6-5-16(12-20(17)33-23)32-25(27)15-4-8-19-22(11-15)31-13-30-19/h3-12H,13H2,1-2H3/b23-10-InChIKey
RHHIYGWIMMMHKX-RMORIDSASA-NSynonyms
858764-42-8((2Z)2((34DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)2(34dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2(34dimethoxybenzylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((34DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLANE5CARBOXYLATE
858764428
COC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5)OC
COc1cc(ccc1OC)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
InChI=1SC25H18O8c128187314(921(18)292)102324(26)176516(1220(17)3323)3225(27)15481922(1115)31133019h312H13H212H3b2310
MFCD04143849
ZINC000002100123
ZINC02100123
ZINC2100123
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