Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxobutan-2-yl acetate
Catalog ID
STL435977
SMILES COc1ccc(cc1)C(=O)CC(Cc1ccc2c(c1)OCO2)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 C20H20O6 MW 356.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20O6/c1-13(21)26-17(9-14-3-8-19-20(10-14)25-12-24-19)11-18(22)15-4-6-16(23-2)7-5-15/h3-8,10,17H,9,11-12H2,1-2H3InChIKey
QTUSYDJPYSTDLC-UHFFFAOYSA-NSynonyms
(1(13benzodioxol5yl)4(4methoxyphenyl)4oxobutan2yl)acetate
1(13benzodioxol5yl)4(4methoxyphenyl)4oxobutan2ylacetate
CC(=O)OC(CC1=CC2=C(C=C1)OCO2)CC(=O)C3=CC=C(C=C3)OC
InChI=1SC20H20O6c113(21)2617(914381920(1014)25122419)1118(22)154616(232)7515h381017H91112H212H3
MFCD30711883
ZINC000253470621
ZINC000253470622
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