Vitas-M small molecule compound
methyl 3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}-3-(5-methylfuran-2-yl)propanoate
Catalog ID
STL315811
SMILES COC(=O)CC(c1oc(CSc2ccccc2)cc(=O)c1O)c1ccc(o1)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 C21H20O6S MW 400.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O6S/c1-13-8-9-18(26-13)16(11-19(23)25-2)21-20(24)17(22)10-14(27-21)12-28-15-6-4-3-5-7-15/h3-10,16,24H,11-12H2,1-2H3InChIKey
LDMXPJPFDCSTKM-UHFFFAOYSA-NSynonyms
1435980-25-81435980258
CC1=CC=C(O1)C(CC(=O)OC)C2=C(C(=O)C=C(O2)CSC3=CC=CC=C3)O
InChI=1SC21H20O6Sc1138918(2613)16(1119(23)252)2120(24)17(22)1014(2721)1228156435715h3101624H1112H212H3
methyl3(3hydroxy4oxo6((phenylsulfanyl)methyl)4Hpyran2yl)3(5methylfuran2yl)propanoate
methyl3(3hydroxy4oxo6((phenylthio)methyl)4Hpyran2yl)3(5methylfuran2yl)propanoate
methyl3(3hydroxy4oxo6(phenylsulfanylmethyl)pyran2yl)3(5methylfuran2yl)propanoate
MFCD23139978
ZINC000095477309
ZINC000095477310
Check stock
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Check stock on Vitas-MAvailable files
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