Vitas-M small molecule compound
(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)[3-(3,4-dimethoxyphenyl)oxiran-2-yl]methanone
Catalog ID
STL435968
SMILES COc1cc(ccc1OC)C1OC1C(=O)c1c(OC)c(OC)c2c(c1Br)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 C20H19BrO8 MW 467.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrO8/c1-23-10-6-5-9(7-11(10)24-2)15-18(29-15)14(22)12-13(21)17-20(28-8-27-17)19(26-4)16(12)25-3/h5-7,15,18H,8H2,1-4H3InChIKey
CIBNEMZCWYHNPO-UHFFFAOYSA-NSynonyms
(4bromo67dimethoxy13benzodioxol5yl)(3(34dimethoxyphenyl)oxiran2yl)methanone
COC1=C(C=C(C=C1)C2C(O2)C(=O)C3=C(C(=C4C(=C3Br)OCO4)OC)OC)OC
InChI=1SC20H19BrO8c12310659(711(10)242)1518(2915)14(22)1213(21)1720(2882717)19(264)16(12)253h571518H8H214H3
MFCD30711875
ZINC000253470537
ZINC000253470540
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