Vitas-M small molecule compound
2-[1-(1,3-benzodioxol-5-yl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-N-butylacetamide
Catalog ID
STL533678
SMILES CCCCNC(=O)CN1CCC2(C(C1c1ccc3c(c1)OCO3)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 C22H32N2O4 MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O4/c1-2-3-11-23-20(25)14-24-12-10-22(26)9-5-4-6-17(22)21(24)16-7-8-18-19(13-16)28-15-27-18/h7-8,13,17,21,26H,2-6,9-12,14-15H2,1H3,(H,23,25)InChIKey
SQJFPBQPHGBKIT-UHFFFAOYSA-NSynonyms
2((1R)1(benzo(d)(13)dioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)Nbutylacetamide
2(1(13benzodioxol5yl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)~(N)butylacetamide
2(1(13benzodioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)Nbutylacetamide
3741089
CCCCNC(=O)CN1CCC2(C((C@@H)1c1ccc3c(c1)OCO3)CCCC2)O
InChI=1SC22H32N2O4c123112320(25)1424121022(26)954617(22)21(24)16781819(1316)28152718h7813172126H269121415H21H3(H2325)
MFCD04143704
ZINC000002155107
ZINC000504268150
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