Vitas-M small molecule compound
methyl 3-(3-hydroxy-4-oxo-4H-chromen-2-yl)-3-[4-(methylsulfanyl)phenyl]propanoate
Catalog ID
STL543129
SMILES COC(=O)CC(c1oc2ccccc2c(=O)c1O)c1ccc(cc1)SC
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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 C20H18O5S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18O5S/c1-24-17(21)11-15(12-7-9-13(26-2)10-8-12)20-19(23)18(22)14-5-3-4-6-16(14)25-20/h3-10,15,23H,11H2,1-2H3InChIKey
ZYYGNXQLMMTMES-UHFFFAOYSA-NSynonyms
110207752
InChI=1SC20H18O5Sc12417(21)1115(127913(262)10812)2019(23)18(22)14534616(14)2520h3101523H11H212H3
methyl3(3hydroxy4oxo4Hchromen2yl)3(4(methylsulfanyl)phenyl)propanoate
METHYL3(3HYDROXY4OXO4HCHROMEN2YL)3(4(METHYLTHIO)PHENYL)PROPANOATE
methyl3(3hydroxy4oxochromen2yl)3(4methylsulfanylphenyl)propanoate
MFCD29056298
ZINC000253415200
ZINC000253415201
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