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-hydroxy-4-methoxyphenyl)propanoate
Catalog ID
STL547407
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2c2cc(OC)c(c(c2)OC)OC)cc(c(c3)OC)OC)cc(=O)c1O)c1ccc(c(c1)O)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 C37H41NO12 MW 691.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H41NO12/c1-43-28-9-8-20(12-26(28)39)25(18-33(41)48-6)36-35(42)27(40)16-23(50-36)19-38-11-10-21-13-29(44-2)30(45-3)17-24(21)34(38)22-14-31(46-4)37(49-7)32(15-22)47-5/h8-9,12-17,25,34,39,42H,10-11,18-19H2,1-7H3InChIKey
AVDAMQNALPSANO-UHFFFAOYSA-NSynonyms
110207322
InChI=1SC37H41NO12c143289820(1226(28)39)25(1833(41)486)3635(42)27(40)1623(5036)19381110211329(442)30(453)1724(21)34(38)221431(464)37(497)32(1522)475h89121725343942H10111819H217H3
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(3hydroxy4methoxyphenyl)propanoate
methyl3(6((67dimethoxy1(345trimethoxyphenyl)34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(3hydroxy4methoxyphenyl)propanoate
MFCD29056103
ZINC000253396152
ZINC000253396159
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