Vitas-M small molecule compound
methyl 3-(1,3-benzodioxol-5-yl)-3-{6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-3-hydroxy-4-oxo-4H-pyran-2-yl}propanoate
Catalog ID
STL545848
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)c1ccc2c(c1)OCO2
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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 C28H29NO9 MW 523.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO9/c1-33-23-8-16-6-7-29(13-18(16)10-24(23)34-2)14-19-11-21(30)27(32)28(38-19)20(12-26(31)35-3)17-4-5-22-25(9-17)37-15-36-22/h4-5,8-11,20,32H,6-7,12-15H2,1-3H3InChIKey
YCLDHDRFUOEJOI-UHFFFAOYSA-NSynonyms
121541888
InChI=1SC28H29NO9c133238166729(1318(16)1024(23)342)14191121(30)27(32)28(3819)20(1226(31)353)17452225(917)37153622h458112032H671215H213H3
methyl3(13benzodioxol5yl)3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)propanoate
methyl3(13benzodioxol5yl)3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)propanoate
METHYL3(BENZO(D)(13)DIOXOL5YL)3(6((67DIMETHOXY34DIHYDROISOQUINOLIN2(1H)YL)METHYL)3HYDROXY4OXO4HPYRAN2YL)PROPANOATE
MFCD30344429
ZINC000263586801
ZINC000263586802
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