Vitas-M small molecule compound
[1-(1,3-benzodioxol-5-yl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](furan-2-yl)methanone
Catalog ID
STL529382
SMILES O=C(N1CCC2(C(C1c1ccc3c(c1)OCO3)CCCC2)O)c1ccco1
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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 C21H23NO5 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5/c23-20(17-5-3-11-25-17)22-10-9-21(24)8-2-1-4-15(21)19(22)14-6-7-16-18(12-14)27-13-26-16/h3,5-7,11-12,15,19,24H,1-2,4,8-10,13H2InChIKey
LVUOKRPGTOQAIM-UHFFFAOYSA-NSynonyms
((1R)1(benzo(d)(13)dioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)(furan2yl)methanone
(1(13benzodioxol5yl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)(furan2yl)methanone
(1(13benzodioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)(furan2yl)methanone
3470495
InChI=1SC21H23NO5c2320(1753112517)2210921(24)821415(21)19(22)14671618(1214)27132616h3571112151924H12481013H2
MFCD04144733
O=C(N1CCC2(C((C@@H)1c1ccc3c(c1)OCO3)CCCC2)O)c1ccco1
ZINC000002102382
ZINC000016031630
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