Vitas-M small molecule compound

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

Catalog ID
STK923343
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)OC)OC)/C2=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 C21H20O7 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O7/c1-12(21(23)26-4)27-14-6-7-15-17(11-14)28-19(20(15)22)10-13-5-8-16(24-2)18(9-13)25-3/h5-12H,1-4H3/b19-10-
InChIKey
MGZDIUKPGJDNQU-GRSHGNNSSA-N
Synonyms
859139-07-4
(Z)methyl2((2(34dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
859139074
CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=C(C=C3)OC)OC)O2
COC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccc(c(c1)OC)OC)C2=O)C
InChI=1SC21H20O7c112(21(23)264)2714671517(1114)2819(20(15)22)10135816(242)18(913)253h512H14H3b1910
METHYL2(((2Z)2((34DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((2Z)2(34dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(2((34DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD04146908
ZINC000005961492
ZINC000006072790

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Available files

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