Vitas-M small molecule compound
5,7-dimethoxy-4-methyl-6-[(2E)-3-methyl-6-(morpholin-4-yl)-6-oxohex-2-en-1-yl]-2-benzofuran-1(3H)-one
Catalog ID
STL475709
SMILES COc1c(C/C=C(/CCC(=O)N2CCOCC2)\C)c(OC)c2c(c1C)COC2=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 C22H29NO6 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6/c1-14(6-8-18(24)23-9-11-28-12-10-23)5-7-16-20(26-3)15(2)17-13-29-22(25)19(17)21(16)27-4/h5H,6-13H2,1-4H3/b14-5+InChIKey
XGBOQAQJALOONV-LHHJGKSTSA-NSynonyms
1630908-32-5(E)57dimethoxy4methyl6(3methyl6morpholino6oxohex2en1yl)isobenzofuran1(3H)one
1630908325
57dimethoxy4methyl6((2E)3methyl6(morpholin4yl)6oxohex2en1yl)2benzofuran1(3H)one
57dimethoxy4methyl6((E)3methyl6morpholin4yl6oxohex2enyl)3H2benzofuran1one
CC1=C(C(=C(C2=C1COC2=O)OC)CC=C(C)CCC(=O)N3CCOCC3)OC
COc1c(CC=C(CCC(=O)N2CCOCC2)C)c(OC)c2c(c1C)COC2=O
InChI=1SC22H29NO6c114(6818(24)2391128121023)571620(263)15(2)17132922(25)19(17)21(16)274h5H613H214H3b145+
MFCD28349912
ZINC000217874806
ZINC217874806
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