Vitas-M small molecule compound

methyl {[(2Z)-2-(2,4-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate

Catalog ID
STL033385
SMILES COC(=O)COc1ccc2c(c1C)O/C(=C\c1ccc(cc1OC)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 C21H20O7 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O7/c1-12-16(27-11-19(22)26-4)8-7-15-20(23)18(28-21(12)15)9-13-5-6-14(24-2)10-17(13)25-3/h5-10H,11H2,1-4H3/b18-9-
InChIKey
PDPRCQDZPXPLCO-NVMNQCDNSA-N
Synonyms
859131-24-1
(Z)methyl2((2(24dimethoxybenzylidene)7methyl3oxo23dihydrobenzofuran6yl)oxy)acetate
859131241
CC1=C(C=CC2=C1OC(=CC3=C(C=C(C=C3)OC)OC)C2=O)OCC(=O)OC
COC(=O)COc1ccc2c(c1C)OC(=Cc1ccc(cc1OC)OC)C2=O
InChI=1SC21H20O7c11216(271119(22)264)871520(23)18(2821(12)15)9135614(242)1017(13)253h510H11H214H3b189
methyl(((2Z)2(24dimethoxybenzylidene)7methyl3oxo23dihydro1benzofuran6yl)oxy)acetate
METHYL2(((2Z)2((24DIMETHOXYPHENYL)METHYLIDENE)7METHYL3OXO1BENZOFURAN6YL)OXY)ACETATE
METHYL2(2((24DIMETHOXYPHENYL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLOXY)ACETATE
MFCD06492661
ZINC000006074086
ZINC06074086
ZINC6074086

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.