Vitas-M small molecule compound
methyl 3-(1,3-benzodioxol-5-yl)-3-(6-{[(4-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)propanoate
Catalog ID
STL434584
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2)F)cc(=O)c1O)c1ccc2c(c1)OCO2
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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 C23H19FO7S MW 458.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19FO7S/c1-28-21(26)10-17(13-2-7-19-20(8-13)30-12-29-19)23-22(27)18(25)9-15(31-23)11-32-16-5-3-14(24)4-6-16/h2-9,17,27H,10-12H2,1H3InChIKey
MXJBWUVNAQXDAY-UHFFFAOYSA-NSynonyms
COC(=O)CC(C1=CC2=C(C=C1)OCO2)C3=C(C(=O)C=C(O3)CSC4=CC=C(C=C4)F)O
InChI=1SC23H19FO7Sc12821(26)1017(13271920(813)30122919)2322(27)18(25)915(3123)1132165314(24)4616h291727H1012H21H3
methyl3(13benzodioxol5yl)3(6(((4fluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)propanoate
methyl3(13benzodioxol5yl)3(6((4fluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)propanoate
MFCD30711232
ZINC000096335869
ZINC000096335870
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Check stock on Vitas-MAvailable files
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