Vitas-M small molecule compound
ethyl 7-({[5-(acetyloxy)-2-methyl-1-benzofuran-3-yl]carbonyl}oxy)-3-(4-bromophenyl)-4-oxo-4H-chromene-2-carboxylate
Catalog ID
STK543015
SMILES CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccc(cc1)Br)OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)C
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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 C30H21BrO9 MW 605.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21BrO9/c1-4-36-30(35)28-26(17-5-7-18(31)8-6-17)27(33)21-11-9-20(14-24(21)40-28)39-29(34)25-15(2)37-23-12-10-19(13-22(23)25)38-16(3)32/h5-14H,4H2,1-3H3InChIKey
PHMJTHVFLLWYCX-UHFFFAOYSA-NSynonyms
3((3(4BROMOPHENYL)2(ETHOXYCARBONYL)4OXOCHROMEN7YL)OXYCARBONYL)2METHYLBENZO(B)FURAN5YLACETATE
CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=C(OC4=C3C=C(C=C4)OC(=O)C)C)C5=CC=C(C=C5)Br
ethyl7(((5(acetyloxy)2methyl1benzofuran3yl)carbonyl)oxy)3(4bromophenyl)4oxo4Hchromene2carboxylate
ethyl7((5acetoxy2methylbenzofuran3carbonyl)oxy)3(4bromophenyl)4oxo4Hchromene2carboxylate
ETHYL7(5ACETYLOXY2METHYL1BENZOFURAN3CARBONYL)OXY3(4BROMOPHENYL)4OXOCHROMENE2CARBOXYLATE
InChI=1SC30H21BrO9c143630(35)2826(175718(31)8617)27(33)2111920(1424(21)4028)3929(34)2515(2)3723121019(1322(23)25)3816(3)32h514H4H213H3
MFCD03297527
ZINC000011867664
ZINC11867664
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