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}-5-methylhexanoate
Catalog ID
STL547643
SMILES COC(=O)CC(c1oc(CN2CCc3c(C2)cc(c(c3)OC)OC)cc(=O)c1O)CC(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 C25H33NO7 MW 459.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO7/c1-15(2)8-17(11-23(28)32-5)25-24(29)20(27)12-19(33-25)14-26-7-6-16-9-21(30-3)22(31-4)10-18(16)13-26/h9-10,12,15,17,29H,6-8,11,13-14H2,1-5H3InChIKey
WNZQZTHEGWJIPZ-UHFFFAOYSA-NSynonyms
121541951
InChI=1SC25H33NO7c115(2)817(1123(28)325)2524(29)20(27)1219(3325)14267616921(303)22(314)1018(16)1326h91012151729H68111314H215H3
methyl3(6((67dimethoxy34dihydro1~(H)isoquinolin2yl)methyl)3hydroxy4oxopyran2yl)5methylhexanoate
methyl3(6((67dimethoxy34dihydroisoquinolin2(1H)yl)methyl)3hydroxy4oxo4Hpyran2yl)5methylhexanoate
MFCD30344466
ZINC000263586653
ZINC000263586654
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