Vitas-M small molecule compound
methyl 3-[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]-3-(thiophen-3-yl)propanoate
Catalog ID
STL550828
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cccc3)cc(=O)c1O)c1ccsc1
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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 C23H23NO5S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO5S/c1-28-21(26)11-19(17-7-9-30-14-17)23-22(27)20(25)10-18(29-23)13-24-8-6-15-4-2-3-5-16(15)12-24/h2-5,7,9-10,14,19,27H,6,8,11-13H2,1H3InChIKey
ZZLZBXYVDCERQI-UHFFFAOYSA-NSynonyms
129895063
InChI=1SC23H23NO5Sc12821(26)1119(1779301417)2322(27)20(25)1018(2923)13248615423516(15)1224h257910141927H681113H21H3
methyl3(6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(thiophen3yl)propanoate
methyl3(6(34dihydro1~(H)isoquinolin2ylmethyl)3hydroxy4oxopyran2yl)3thiophen3ylpropanoate
methyl3(6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy4oxo4Hpyran2yl)3(thiophen3yl)propanoate
MFCD31757796
ZINC000524730216
ZINC000524730217
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