Vitas-M small molecule compound
1-[1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]butan-1-one
Catalog ID
STL512285
SMILES CCCC(=O)N1CCC2(C(C1c1ccc(cc1OC)OC)CCCC2)O
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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 C21H31NO4 MW 361.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31NO4/c1-4-7-19(23)22-13-12-21(24)11-6-5-8-17(21)20(22)16-10-9-15(25-2)14-18(16)26-3/h9-10,14,17,20,24H,4-8,11-13H2,1-3H3InChIKey
JIMJQWPAOQTXPM-UHFFFAOYSA-NSynonyms
1((1R)1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)butan1one
1(1(24dimethoxyphenyl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)butan1one
1(1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)butan1one
3776982
CCCC(=O)N1CCC2(C((C@@H)1c1ccc(cc1OC)OC)CCCC2)O
InChI=1SC21H31NO4c14719(23)22131221(24)1165817(21)20(22)1610915(252)1418(16)263h91014172024H481113H213H3
MFCD04146728
ZINC000002107483
ZINC000503917936
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