Vitas-M small molecule compound
ethyl 3-(2-chloro-6-fluorophenyl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Catalog ID
STL157657
SMILES CCOC(=O)CC(c1c(F)cccc1Cl)c1oc(CO)cc(=O)c1O
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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 C17H16ClFO6 MW 370.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClFO6/c1-2-24-14(22)7-10(15-11(18)4-3-5-12(15)19)17-16(23)13(21)6-9(8-20)25-17/h3-6,10,20,23H,2,7-8H2,1H3InChIKey
QVFNAFMLUVKNMB-UHFFFAOYSA-NSynonyms
1324085-03-11324085031
CCOC(=O)CC(C1=C(C=CC=C1Cl)F)C2=C(C(=O)C=C(O2)CO)O
ethyl3(2chloro6fluorophenyl)3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)propanoate
ethyl3(2chloro6fluorophenyl)3(3hydroxy6(hydroxymethyl)4oxopyran2yl)propanoate
InChI=1SC17H16ClFO6c122414(22)710(1511(18)43512(15)19)1716(23)13(21)69(820)2517h36102023H278H21H3
MFCD19710067
ZINC000071283021
ZINC000071283022
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