Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[(4-methoxyphenyl)sulfanyl]methyl}-4-oxo-4H-pyran-2-yl)-3-(pyridin-3-yl)propanoate
Catalog ID
STL316899
SMILES COC(=O)CC(c1oc(CSc2ccc(cc2)OC)cc(=O)c1O)c1cccnc1
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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 C22H21NO6S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6S/c1-27-15-5-7-17(8-6-15)30-13-16-10-19(24)21(26)22(29-16)18(11-20(25)28-2)14-4-3-9-23-12-14/h3-10,12,18,26H,11,13H2,1-2H3InChIKey
FPCAZYBHXYQYPD-UHFFFAOYSA-NSynonyms
1574309-98-01574309980
COC1=CC=C(C=C1)SCC2=CC(=O)C(=C(O2)C(CC(=O)OC)C3=CN=CC=C3)O
InChI=1SC22H21NO6Sc127155717(8615)3013161019(24)21(26)22(2916)18(1120(25)282)14439231214h310121826H1113H212H3
methyl3(3hydroxy6(((4methoxyphenyl)sulfanyl)methyl)4oxo4Hpyran2yl)3(pyridin3yl)propanoate
methyl3(3hydroxy6(((4methoxyphenyl)thio)methyl)4oxo4Hpyran2yl)3(pyridin3yl)propanoate
methyl3(3hydroxy6((4methoxyphenyl)sulfanylmethyl)4oxopyran2yl)3pyridin3ylpropanoate
MFCD28028081
ZINC000095478114
ZINC000095478115
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