Vitas-M small molecule compound
ethyl 3-[4-(difluoromethoxy)-3-methoxyphenyl]-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Catalog ID
STL246376
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(c(c1)OC)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 C19H20F2O8 MW 414.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20F2O8/c1-3-27-16(24)8-12(18-17(25)13(23)7-11(9-22)28-18)10-4-5-14(29-19(20)21)15(6-10)26-2/h4-7,12,19,22,25H,3,8-9H2,1-2H3InChIKey
PEJQLXZDZYZFNE-UHFFFAOYSA-NSynonyms
1351701-74-01351701740
CCOC(=O)CC(C1=CC(=C(C=C1)OC(F)F)OC)C2=C(C(=O)C=C(O2)CO)O
ethyl3(4(difluoromethoxy)3methoxyphenyl)3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)propanoate
ethyl3(4(difluoromethoxy)3methoxyphenyl)3(3hydroxy6(hydroxymethyl)4oxopyran2yl)propanoate
InChI=1SC19H20F2O8c132716(24)812(1817(25)13(23)711(922)2818)104514(2919(20)21)15(610)262h4712192225H389H212H3
MFCD20536047
ZINC000072400864
ZINC000072400865
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