Vitas-M small molecule compound
methyl 3-(6-{[(4-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoate
Catalog ID
STL434583
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2)F)cc(=O)c1O)c1cc(OC)c2c(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 C24H21FO8S MW 488.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FO8S/c1-29-19-7-13(8-20-24(19)32-12-31-20)17(10-21(27)30-2)23-22(28)18(26)9-15(33-23)11-34-16-5-3-14(25)4-6-16/h3-9,17,28H,10-12H2,1-2H3InChIKey
QSYYEBGXBNOMSK-UHFFFAOYSA-NSynonyms
COC1=CC(=CC2=C1OCO2)C(CC(=O)OC)C3=C(C(=O)C=C(O3)CSC4=CC=C(C=C4)F)O
InChI=1SC24H21FO8Sc12919713(82024(19)32123120)17(1021(27)302)2322(28)18(26)915(3323)1134165314(25)4616h391728H1012H212H3
methyl3(6(((4fluorophenyl)sulfanyl)methyl)3hydroxy4oxo4Hpyran2yl)3(7methoxy13benzodioxol5yl)propanoate
methyl3(6((4fluorophenyl)sulfanylmethyl)3hydroxy4oxopyran2yl)3(7methoxy13benzodioxol5yl)propanoate
MFCD30711231
ZINC000096335867
ZINC000096335868
Check stock
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