Vitas-M small molecule compound
methyl 3-[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]-4-methylpentanoate
Catalog ID
STL551320
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cccc3)cc(=O)c1O)C(C)C
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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 C22H27NO5 MW 385.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5/c1-14(2)18(11-20(25)27-3)22-21(26)19(24)10-17(28-22)13-23-9-8-15-6-4-5-7-16(15)12-23/h4-7,10,14,18,26H,8-9,11-13H2,1-3H3InChIKey
LHNDFWMSRQVIIJ-UHFFFAOYSA-NSynonyms
129895533
InChI=1SC22H27NO5c114(2)18(1120(25)273)2221(26)19(24)1017(2822)13239815645716(15)1223h4710141826H891113H213H3
methyl3(6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)4methylpentanoate
methyl3(6(34dihydro1~(H)isoquinolin2ylmethyl)3hydroxy4oxopyran2yl)4methylpentanoate
methyl3(6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy4oxo4Hpyran2yl)4methylpentanoate
MFCD31758069
ZINC000524731139
ZINC000524731140
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