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-(3-hydroxy-4-methoxyphenyl)propanoate
Catalog ID
STL548957
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)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 C28H31NO9 MW 525.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO9/c1-34-23-6-5-17(9-21(23)30)20(13-26(32)37-4)28-27(33)22(31)12-19(38-28)15-29-8-7-16-10-24(35-2)25(36-3)11-18(16)14-29/h5-6,9-12,20,30,33H,7-8,13-15H2,1-4H3InChIKey
CIHGERLQPOZJIA-UHFFFAOYSA-NSynonyms
121541020
InChI=1SC28H31NO9c134236517(921(23)30)20(1326(32)374)2827(33)22(31)1219(3828)152987161024(352)25(363)1118(16)1429h56912203033H781315H214H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(3hydroxy4methoxyphenyl)propanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(3hydroxy4methoxyphenyl)propanoate
MFCD30343985
ZINC000263584947
ZINC000263584948
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