Vitas-M small molecule compound
methyl 3-[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]-3-(4-oxo-4H-chromen-3-yl)propanoate
Catalog ID
STL550339
SMILES COC(=O)CC(c1coc2c(c1=O)cccc2)c1oc(CN2CCc3c(C2)cccc3)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 C28H25NO7 MW 487.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO7/c1-34-25(31)13-21(22-16-35-24-9-5-4-8-20(24)26(22)32)28-27(33)23(30)12-19(36-28)15-29-11-10-17-6-2-3-7-18(17)14-29/h2-9,12,16,21,33H,10-11,13-15H2,1H3InChIKey
VPVNVKIUXCWZDK-UHFFFAOYSA-NSynonyms
129894762
InChI=1SC28H25NO7c13425(31)1321(22163524954820(24)26(22)32)2827(33)23(30)1219(3628)1529111017623718(17)1429h2912162133H10111315H21H3
methyl3(6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)3(4oxo4Hchromen3yl)propanoate
methyl3(6(34dihydro1~(H)isoquinolin2ylmethyl)3hydroxy4oxopyran2yl)3(4oxochromen3yl)propanoate
methyl3(6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy4oxo4Hpyran2yl)3(4oxo4Hchromen3yl)propanoate
MFCD31757533
ZINC000524729485
ZINC000524729486
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