Vitas-M small molecule compound

methyl 3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}-3-(4-methoxyphenyl)propanoate

Catalog ID
STL539362
SMILES COC(=O)CC(c1oc(CSc2ccccc2)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 C23H22O6S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O6S/c1-27-16-10-8-15(9-11-16)19(13-21(25)28-2)23-22(26)20(24)12-17(29-23)14-30-18-6-4-3-5-7-18/h3-12,19,26H,13-14H2,1-2H3
InChIKey
JBYWITBQUNXHMF-UHFFFAOYSA-N
Synonyms
1435993-08-0
1435993080
71755048
InChI=1SC23H22O6Sc1271610815(91116)19(1321(25)282)2322(26)20(24)1217(2923)1430186435718h3121926H1314H212H3
methyl3(3hydroxy4oxo6((phenylsulfanyl)methyl)4Hpyran2yl)3(4methoxyphenyl)propanoate
METHYL3(3HYDROXY4OXO6((PHENYLTHIO)METHYL)4HPYRAN2YL)3(4METHOXYPHENYL)PROPANOATE
methyl3(3hydroxy4oxo6(phenylsulfanylmethyl)pyran2yl)3(4methoxyphenyl)propanoate
MFCD23136605
ZINC000085878497
ZINC000085878501

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.