Vitas-M small molecule compound
ethyl 3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-[4-(prop-2-yn-1-yloxy)phenyl]propanoate
Catalog ID
STL159636
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(cc1)OCC#C
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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 C20H20O7 MW 372.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20O7/c1-3-9-26-14-7-5-13(6-8-14)16(11-18(23)25-4-2)20-19(24)17(22)10-15(12-21)27-20/h1,5-8,10,16,21,24H,4,9,11-12H2,2H3InChIKey
DGHQURUCVUHGTR-UHFFFAOYSA-NSynonyms
1324089-00-01324089000
CCOC(=O)CC(C1=CC=C(C=C1)OCC#C)C2=C(C(=O)C=C(O2)CO)O
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)3(4(prop2yn1yloxy)phenyl)propanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxopyran2yl)3(4prop2ynoxyphenyl)propanoate
InChI=1SC20H20O7c13926147513(6814)16(1118(23)2542)2019(24)17(22)1015(1221)2720h15810162124H491112H22H3
MFCD19708395
ZINC000071279621
ZINC000071279622
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