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-(2-hydroxy-7-methoxyquinolin-3-yl)propanoate
Catalog ID
STL547149
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)c1cc2ccc(cc2nc1O)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 C31H32N2O9 MW 576.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O9/c1-38-20-6-5-18-9-23(31(37)32-24(18)12-20)22(14-28(35)41-4)30-29(36)25(34)13-21(42-30)16-33-8-7-17-10-26(39-2)27(40-3)11-19(17)15-33/h5-6,9-13,22,36H,7-8,14-16H2,1-4H3,(H,32,37)InChIKey
VRVWHNLLTQBRMQ-UHFFFAOYSA-NSynonyms
121542278
InChI=1SC31H32N2O9c138206518923(31(37)3224(18)1220)22(1428(35)414)3029(36)25(34)1321(4230)163387171026(392)27(403)1119(17)1533h569132236H781416H214H3(H3237)
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(7methoxy2oxo1~(H)quinolin3yl)propanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(2hydroxy7methoxyquinolin3yl)propanoate
METHYL3(6((67DIMETHOXY34DIHYDROISOQUINOLIN2(1H)YL)METHYL)3HYDROXY4OXO4HPYRAN2YL)3(7METHOXY2OXO12DIHYDROQUINOLIN3YL)PROPANOATE
MFCD31756515
ZINC000263586556
ZINC000263586557
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