Vitas-M small molecule compound
ethyl 3-{4-[(2-fluorobenzyl)oxy]phenyl}-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Catalog ID
STL434511
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(cc1)OCc1ccccc1F
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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 C24H23FO7 MW 442.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23FO7/c1-2-30-22(28)12-19(24-23(29)21(27)11-18(13-26)32-24)15-7-9-17(10-8-15)31-14-16-5-3-4-6-20(16)25/h3-11,19,26,29H,2,12-14H2,1H3InChIKey
RXNSPIVYCQRWPX-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(C1=CC=C(C=C1)OCC2=CC=CC=C2F)C3=C(C(=O)C=C(O3)CO)O
ethyl3(4((2fluorobenzyl)oxy)phenyl)3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)propanoate
ethyl3(4((2fluorophenyl)methoxy)phenyl)3(3hydroxy6(hydroxymethyl)4oxopyran2yl)propanoate
InChI=1SC24H23FO7c123022(28)1219(2423(29)21(27)1118(1326)3224)157917(10815)311416534620(16)25h311192629H21214H21H3
MFCD30711165
ZINC000096335752
ZINC000096335753
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