Vitas-M small molecule compound
ethyl 3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-[4-methoxy-3-(2-methylpropoxy)phenyl]propanoate
Catalog ID
STL154215
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(c(c1)OCC(C)C)OC
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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 C22H28O8 MW 420.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O8/c1-5-28-20(25)10-16(22-21(26)17(24)9-15(11-23)30-22)14-6-7-18(27-4)19(8-14)29-12-13(2)3/h6-9,13,16,23,26H,5,10-12H2,1-4H3InChIKey
PYFRYHDOPBKERN-UHFFFAOYSA-NSynonyms
1324062-46-51324062465
CCOC(=O)CC(C1=CC(=C(C=C1)OC)OCC(C)C)C2=C(C(=O)C=C(O2)CO)O
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)3(3isobutoxy4methoxyphenyl)propanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)3(4methoxy3(2methylpropoxy)phenyl)propanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxopyran2yl)3(4methoxy3(2methylpropoxy)phenyl)propanoate
InChI=1SC22H28O8c152820(25)1016(2221(26)17(24)915(1123)3022)146718(274)19(814)291213(2)3h6913162326H51012H214H3
MFCD19709537
ZINC000071281988
ZINC000071281990
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