Vitas-M small molecule compound

2,2'-{[3-(difluoromethoxy)phenyl]methanediyl}bis[3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one]

Catalog ID
STL320593
SMILES OCc1cc(=O)c(c(o1)C(c1oc(CO)cc(=O)c1O)c1cccc(c1)OC(F)F)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 C20H16F2O9 MW 438.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F2O9/c21-20(22)31-10-3-1-2-9(4-10)15(18-16(27)13(25)5-11(7-23)29-18)19-17(28)14(26)6-12(8-24)30-19/h1-6,15,20,23-24,27-28H,7-8H2
InChIKey
MVTSAPNFAKERQI-UHFFFAOYSA-N
Synonyms
1574408-80-2
1574408802
2((3(difluoromethoxy)phenyl)(3hydroxy6(hydroxymethyl)4oxopyran2yl)methyl)3hydroxy6(hydroxymethyl)pyran4one
22((3(difluoromethoxy)phenyl)methanediyl)bis(3hydroxy6(hydroxymethyl)4Hpyran4one)
66((3(difluoromethoxy)phenyl)methylene)bis(5hydroxy2(hydroxymethyl)4Hpyran4one)
C1=CC(=CC(=C1)OC(F)F)C(C2=C(C(=O)C=C(O2)CO)O)C3=C(C(=O)C=C(O3)CO)O
InChI=1SC20H16F2O9c2120(22)31103129(410)15(1816(27)13(25)511(723)2918)1917(28)14(26)612(824)3019h16152023242728H78H2
MFCD28029582
ZINC000095480920
ZINC95480920

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Available files

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