Vitas-M small molecule compound
methyl 3-{6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}-3-(pyridin-3-yl)propanoate
Catalog ID
STL548347
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)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 C26H28N2O7 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O7/c1-32-22-9-16-6-8-28(14-18(16)10-23(22)33-2)15-19-11-21(29)25(31)26(35-19)20(12-24(30)34-3)17-5-4-7-27-13-17/h4-5,7,9-11,13,20,31H,6,8,12,14-15H2,1-3H3InChIKey
TVOPZKKHTKHODE-UHFFFAOYSA-NSynonyms
121541012
InChI=1SC26H28N2O7c132229166828(1418(16)1023(22)332)15191121(29)25(31)26(3519)20(1224(30)343)17547271317h457911132031H68121415H213H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3pyridin3ylpropanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(pyridin3yl)propanoate
MFCD30343980
ZINC000263586378
ZINC000263586379
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