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-(quinolin-4-yl)propanoate
Catalog ID
STL547236
SMILES COC(=O)CC(c1ccnc2c1cccc2)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 C30H30N2O7 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O7/c1-36-26-12-18-9-11-32(16-19(18)13-27(26)37-2)17-20-14-25(33)29(35)30(39-20)23(15-28(34)38-3)21-8-10-31-24-7-5-4-6-22(21)24/h4-8,10,12-14,23,35H,9,11,15-17H2,1-3H3InChIKey
KHPDLDLAZBICFC-UHFFFAOYSA-NSynonyms
121541660
InChI=1SC30H30N2O7c13626121891132(1619(18)1327(26)372)17201425(33)29(35)30(3920)23(1528(34)383)218103124754622(21)24h481012142335H9111517H213H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)3quinolin4ylpropanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(quinolin4yl)propanoate
MFCD30344309
ZINC000263585582
ZINC000263585583
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