Vitas-M small molecule compound
ethyl 3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-(2-methoxyphenyl)propanoate
Catalog ID
STL154955
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccccc1OC
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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 C18H20O7 MW 348.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20O7/c1-3-24-16(21)9-13(12-6-4-5-7-15(12)23-2)18-17(22)14(20)8-11(10-19)25-18/h4-8,13,19,22H,3,9-10H2,1-2H3InChIKey
JHIDRFBJWIJKBS-UHFFFAOYSA-NSynonyms
1324064-47-21324064472
CCOC(=O)CC(C1=CC=CC=C1OC)C2=C(C(=O)C=C(O2)CO)O
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)3(2methoxyphenyl)propanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxopyran2yl)3(2methoxyphenyl)propanoate
InChI=1SC18H20O7c132416(21)913(12645715(12)232)1817(22)14(20)811(1019)2518h48131922H3910H212H3
MFCD19710410
ZINC000071283520
ZINC000071283521
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