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-(4-methoxynaphthalen-1-yl)propanoate

Catalog ID
STL548210
SMILES COC(=O)CC(c1ccc(c2c1cccc2)OC)c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O

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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 C32H33NO8 MW 559.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33NO8/c1-37-27-10-9-23(22-7-5-6-8-24(22)27)25(16-30(35)40-4)32-31(36)26(34)15-21(41-32)18-33-12-11-19-13-28(38-2)29(39-3)14-20(19)17-33/h5-10,13-15,25,36H,11-12,16-18H2,1-4H3
InChIKey
JHTWKOASSUGNIQ-UHFFFAOYSA-N
Synonyms

121542084
InChI=1SC32H33NO8c1372710923(22756824(22)27)25(1630(35)404)3231(36)26(34)1521(4132)18331211191328(382)29(393)1420(19)1733h51013152536H11121618H214H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3(4methoxynaphthalen1yl)propanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(4methoxynaphthalen1yl)propanoate
MFCD30344541
ZINC000263585496
ZINC000263585497

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Available files

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