Vitas-M small molecule compound
methyl 3-(6-{[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-[3-(hydroxymethyl)-4-methoxyphenyl]propanoate
Catalog ID
STL548902
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2c2cc(OC)c(c(c2)OC)OC)cc(c(c3)OC)OC)cc(=O)c1O)c1ccc(c(c1)CO)OC
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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 C38H43NO12 MW 705.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H43NO12/c1-44-29-9-8-21(12-24(29)20-40)27(18-34(42)49-6)37-36(43)28(41)16-25(51-37)19-39-11-10-22-13-30(45-2)31(46-3)17-26(22)35(39)23-14-32(47-4)38(50-7)33(15-23)48-5/h8-9,12-17,27,35,40,43H,10-11,18-20H2,1-7H3InChIKey
TWZGYWVMXJXELQ-UHFFFAOYSA-NSynonyms
110207528
InChI=1SC38H43NO12c144299821(1224(29)2040)27(1834(42)496)3736(43)28(41)1625(5137)19391110221330(452)31(463)1726(22)35(39)231432(474)38(507)33(1523)485h89121727354043H10111820H217H3
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(3(hydroxymethyl)4methoxyphenyl)propanoate
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(3(hydroxymethyl)4methoxyphenyl)propanoate
MFCD29056211
ZINC000253413132
ZINC000253413135
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