Vitas-M small molecule compound
methyl 3-(6-{[(4-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4-methoxyphenyl)propanoate
Catalog ID
STL434602
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2)F)cc(=O)c1O)c1ccc(cc1)OC
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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 C23H21FO6S MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FO6S/c1-28-16-7-3-14(4-8-16)19(12-21(26)29-2)23-22(27)20(25)11-17(30-23)13-31-18-9-5-15(24)6-10-18/h3-11,19,27H,12-13H2,1-2H3InChIKey
CLWCNVJZCRBONP-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C(CC(=O)OC)C2=C(C(=O)C=C(O2)CSC3=CC=C(C=C3)F)O
InChI=1SC23H21FO6Sc128167314(4816)19(1221(26)292)2322(27)20(25)1117(3023)1331189515(24)61018h3111927H1213H212H3
methyl3(6(((4fluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)3(4methoxyphenyl)propanoate
methyl3(6((4fluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)3(4methoxyphenyl)propanoate
MFCD30711250
ZINC000096335895
ZINC000096335896
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Check stock on Vitas-MAvailable files
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