Vitas-M small molecule compound
ethyl 3-(4-bromophenyl)-7-{[(5-ethoxy-2-phenyl-1-benzofuran-3-yl)carbonyl]oxy}-4-oxo-4H-chromene-2-carboxylate
Catalog ID
STK544082
SMILES CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccc(cc1)Br)OC(=O)c1c(oc2c1cc(OCC)cc2)c1ccccc1
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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 C35H25BrO8 MW 653.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H25BrO8/c1-3-40-23-15-17-27-26(18-23)30(32(43-27)21-8-6-5-7-9-21)34(38)42-24-14-16-25-28(19-24)44-33(35(39)41-4-2)29(31(25)37)20-10-12-22(36)13-11-20/h5-19H,3-4H2,1-2H3InChIKey
SNGNJFYRDQWMRL-UHFFFAOYSA-NSynonyms
3(4BROMOPHENYL)2(ETHOXYCARBONYL)4OXOCHROMEN7YL5ETHOXY2PHENYLBENZO(B)FURAN3CARBOXYLATE
CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(=O)OCC)C5=CC=C(C=C5)Br)C6=CC=CC=C6
ethyl3(4bromophenyl)7(((5ethoxy2phenyl1benzofuran3yl)carbonyl)oxy)4oxo4Hchromene2carboxylate
ethyl3(4bromophenyl)7((5ethoxy2phenylbenzofuran3carbonyl)oxy)4oxo4Hchromene2carboxylate
ETHYL3(4BROMOPHENYL)7(5ETHOXY2PHENYL1BENZOFURAN3CARBONYL)OXY4OXOCHROMENE2CARBOXYLATE
InChI=1SC35H25BrO8c13402315172726(1823)30(32(4327)218657921)34(38)422414162528(1924)4433(35(39)4142)29(31(25)37)20101222(36)131120h519H34H212H3
MFCD03296758
ZINC000097999512
ZINC97999512
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