Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)-3-(3-hydroxyphenyl)propanoate
Catalog ID
STL539143
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2)C)cc(=O)c1O)c1cccc(c1)O
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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 C23H22O6S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O6S/c1-14-6-8-18(9-7-14)30-13-17-11-20(25)22(27)23(29-17)19(12-21(26)28-2)15-4-3-5-16(24)10-15/h3-11,19,24,27H,12-13H2,1-2H3InChIKey
IVLLUKDRYHFUBQ-UHFFFAOYSA-NSynonyms
1574409-62-31574409623
71826682
InChI=1SC23H22O6Sc1146818(9714)3013171120(25)22(27)23(2917)19(1221(26)282)1543516(24)1015h311192427H1213H212H3
METHYL3(3HYDROXY4OXO6((PTOLYLTHIO)METHYL)4HPYRAN2YL)3(3HYDROXYPHENYL)PROPANOATE
methyl3(3hydroxy6(((4methylphenyl)sulfanyl)methyl)4oxo4Hpyran2yl)3(3hydroxyphenyl)propanoate
methyl3(3hydroxy6((4methylphenyl)sulfanylmethyl)4oxopyran2yl)3(3hydroxyphenyl)propanoate
MFCD28051171
ZINC000096114792
ZINC000096114793
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