Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[(3-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)-5-methylhexanoate
Catalog ID
STL539885
SMILES COC(=O)CC(c1oc(CSc2cccc(c2)OC)cc(=O)c1O)CC(C)C
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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 C21H26O6S MW 406.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26O6S/c1-13(2)8-14(9-19(23)26-4)21-20(24)18(22)11-16(27-21)12-28-17-7-5-6-15(10-17)25-3/h5-7,10-11,13-14,24H,8-9,12H2,1-4H3InChIKey
KDUUZUBPJKNZMW-UHFFFAOYSA-NSynonyms
1435993-79-51435993795
71755028
InChI=1SC21H26O6Sc113(2)814(919(23)264)2120(24)18(22)1116(2721)12281775615(1017)253h571011131424H8912H214H3
methyl3(3hydroxy6(((3methoxyphenyl)sulfanyl)methyl)4oxo4Hpyran2yl)5methylhexanoate
METHYL3(3HYDROXY6(((3METHOXYPHENYL)THIO)METHYL)4OXO4HPYRAN2YL)5METHYLHEXANOATE
methyl3(3hydroxy6((3methoxyphenyl)sulfanylmethyl)4oxopyran2yl)5methylhexanoate
MFCD23136589
ZINC000085878364
ZINC000085878370
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