Vitas-M small molecule compound

methyl 4-({[(2Z)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}methyl)benzoate

Catalog ID
STK923927
SMILES COc1ccc(c(c1)OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCc1ccc(cc1)C(=O)OC

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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 C26H22O7 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22O7/c1-29-19-9-8-18(22(13-19)30-2)12-24-25(27)21-11-10-20(14-23(21)33-24)32-15-16-4-6-17(7-5-16)26(28)31-3/h4-14H,15H2,1-3H3/b24-12-
InChIKey
PBMOLSBZWRBXKQ-MSXFZWOLSA-N
Synonyms
858757-20-7
(Z)methyl4(((2(24dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)methyl)benzoate
858757207
COC1=CC(=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC)OC
COc1ccc(c(c1)OC)C=C1Oc2c(C1=O)ccc(c2)OCc1ccc(cc1)C(=O)OC
InChI=1SC26H22O7c129199818(22(1319)302)122425(27)21111020(1423(21)3324)3215164617(7516)26(28)313h414H15H213H3b2412
methyl4((((2Z)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)methyl)benzoate
METHYL4(((2Z)2((24DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXYMETHYL)BENZOATE
METHYL4((2((24DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)METHYL)BENZOATE
MFCD04142554
ZINC000002097210
ZINC02097210
ZINC2097210

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.