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-[3-methoxy-4-(propan-2-yloxy)phenyl]propanoate
Catalog ID
STL547896
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)c1ccc(c(c1)OC)OC(C)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 C31H37NO9 MW 567.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H37NO9/c1-18(2)40-25-8-7-20(12-26(25)36-3)23(15-29(34)39-6)31-30(35)24(33)14-22(41-31)17-32-10-9-19-11-27(37-4)28(38-5)13-21(19)16-32/h7-8,11-14,18,23,35H,9-10,15-17H2,1-6H3InChIKey
MWGVUAVMRMLDIN-UHFFFAOYSA-NSynonyms
121541380
InChI=1SC31H37NO9c118(2)40258720(1226(25)363)23(1529(34)396)3130(35)24(33)1422(4131)1732109191127(374)28(385)1321(19)1632h781114182335H9101517H216H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(3methoxy4propan2yloxyphenyl)propanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(3methoxy4(propan2yloxy)phenyl)propanoate
METHYL3(6((67DIMETHOXY34DIHYDROISOQUINOLIN2(1H)YL)METHYL)3HYDROXY4OXO4HPYRAN2YL)3(4ISOPROPOXY3METHOXYPHENYL)PROPANOATE
MFCD30344162
ZINC000263585810
ZINC000263585811
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