Vitas-M small molecule compound
methyl 3-[3-(difluoromethoxy)phenyl]-3-[3-hydroxy-6-(morpholin-4-ylmethyl)-4-oxo-4H-pyran-2-yl]propanoate
Catalog ID
STL422857
SMILES COC(=O)CC(c1oc(CN2CCOCC2)cc(=O)c1O)c1cccc(c1)OC(F)F
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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 C21H23F2NO7 MW 439.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F2NO7/c1-28-18(26)11-16(13-3-2-4-14(9-13)31-21(22)23)20-19(27)17(25)10-15(30-20)12-24-5-7-29-8-6-24/h2-4,9-10,16,21,27H,5-8,11-12H2,1H3InChIKey
XGHVJLGKDQMOEO-UHFFFAOYSA-NSynonyms
1630856-80-21630856802
COC(=O)CC(C1=CC(=CC=C1)OC(F)F)C2=C(C(=O)C=C(O2)CN3CCOCC3)O
InChI=1SC21H23F2NO7c12818(26)1116(1332414(913)3121(22)23)2019(27)17(25)1015(3020)122457298624h24910162127H581112H21H3
methyl3(3(difluoromethoxy)phenyl)3(3hydroxy6(morpholin4ylmethyl)4oxo4Hpyran2yl)propanoate
methyl3(3(difluoromethoxy)phenyl)3(3hydroxy6(morpholin4ylmethyl)4oxopyran2yl)propanoate
methyl3(3(difluoromethoxy)phenyl)3(3hydroxy6(morpholinomethyl)4oxo4Hpyran2yl)propanoate
MFCD28367421
ZINC000218260842
ZINC000218260938
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