Vitas-M small molecule compound
methyl 2-({(2Z)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)propanoate
Catalog ID
STK924582
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\C=C\c1ccccc1OC)/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 C22H20O6 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20O6/c1-14(22(24)26-3)27-16-11-12-17-20(13-16)28-19(21(17)23)10-6-8-15-7-4-5-9-18(15)25-2/h4-14H,1-3H3/b8-6+,19-10-InChIKey
PUMCGWKIDDDTMY-YZFGBBDKSA-NSynonyms
620546-47-6620546476
CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC=CC3=CC=CC=C3OC)O2
COC(=O)C(Oc1ccc2c(c1)OC(=CC=Cc1ccccc1OC)C2=O)C
InChI=1SC22H20O6c114(22(24)263)271611121720(1316)2819(21(17)23)106815745918(15)252h414H13H3b86+1910
methyl2(((2Z)2((2E)3(2methoxyphenyl)prop2en1ylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(((2Z)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((Z)2((E)3(2methoxyphenyl)allylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
METHYL2(2((2E)3(2METHOXYPHENYL)PROP2ENYLIDENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD04145216
ZINC000006166298
ZINC000006852765
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