Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-(2-hydroxy-6-methoxyquinolin-3-yl)propanoate
Catalog ID
STL549026
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1cc2cc(OC)ccc2nc1O
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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 C31H33N3O8 MW 575.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O8/c1-39-21-6-4-20(5-7-21)34-12-10-33(11-13-34)18-23-16-27(35)29(37)30(42-23)24(17-28(36)41-3)25-15-19-14-22(40-2)8-9-26(19)32-31(25)38/h4-9,14-16,24,37H,10-13,17-18H2,1-3H3,(H,32,38)InChIKey
MIBJRUFOFRIKEV-UHFFFAOYSA-NSynonyms
110206887
InChI=1SC31H33N3O8c139216420(5721)34121033(111334)18231627(35)29(37)30(4223)24(1728(36)413)2515191422(402)8926(19)3231(25)38h4914162437H10131718H213H3(H3238)
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(2hydroxy6methoxyquinolin3yl)propanoate
METHYL3(3HYDROXY6((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)4OXO4HPYRAN2YL)3(6METHOXY2OXO12DIHYDROQUINOLIN3YL)PROPANOATE
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3(6methoxy2oxo1~(H)quinolin3yl)propanoate
MFCD31756854
ZINC000253623802
ZINC000253623803
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