Vitas-M small molecule compound
N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)propanamide
Catalog ID
STL550174
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NC1C=CS(=O)(=O)C1
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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 C20H21NO8S MW 435.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO8S/c1-11-7-16(23)19(25)20(29-11)14(12-3-4-15(22)17(8-12)28-2)9-18(24)21-13-5-6-30(26,27)10-13/h3-8,13-14,22,25H,9-10H2,1-2H3,(H,21,24)InChIKey
KQRGDAUIDRPQMW-UHFFFAOYSA-NSynonyms
~(N)(11dioxo23dihydrothiophen3yl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)propanamide
129895910
InChI=1SC20H21NO8Sc111716(23)19(25)20(2911)14(123415(22)17(812)282)918(24)21135630(2627)1013h3813142225H910H212H3(H2124)
MFCD31757437
N(11dioxido23dihydrothiophen3yl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanamide
ZINC000524731794
ZINC000524731797
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