Vitas-M small molecule compound
methyl 4-[({(2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)methyl]benzoate
Catalog ID
STK923307
SMILES COC(=O)c1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(=O)OC)/C2=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 C26H20O7 MW 444.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O7/c1-30-25(28)18-7-3-16(4-8-18)13-23-24(27)21-12-11-20(14-22(21)33-23)32-15-17-5-9-19(10-6-17)26(29)31-2/h3-14H,15H2,1-2H3/b23-13-InChIKey
BIXAQBBHFULBQA-QRVIBDJDSA-NSynonyms
858767-86-9(Z)methyl4((6((4(methoxycarbonyl)benzyl)oxy)3oxobenzofuran2(3H)ylidene)methyl)benzoate
858767869
COC(=O)C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)O3
COC(=O)c1ccc(cc1)COc1ccc2c(c1)OC(=Cc1ccc(cc1)C(=O)OC)C2=O
InChI=1SC26H20O7c13025(28)187316(4818)132324(27)21121120(1422(21)3323)3215175919(10617)26(29)312h314H15H212H3b2313
methyl4((((2Z)2(4(methoxycarbonyl)benzylidene)3oxo23dihydro1benzofuran6yl)oxy)methyl)benzoate
METHYL4(((2Z)2((4METHOXYCARBONYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXYMETHYL)BENZOATE
METHYL4((2((4(METHOXYCARBONYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)METHYL)BENZOATE
MFCD04145219
ZINC000008917863
ZINC08917863
ZINC8917863
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.