Vitas-M small molecule compound
2-[(1R,4aS,8aS)-1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-N-propylacetamide
Catalog ID
STL545823
SMILES CCCNC(=O)CN1CC[C@@]2([C@H]([C@@H]1c1cc(OC)ccc1OC)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 C22H34N2O4 MW 390.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H34N2O4/c1-4-12-23-20(25)15-24-13-11-22(26)10-6-5-7-18(22)21(24)17-14-16(27-2)8-9-19(17)28-3/h8-9,14,18,21,26H,4-7,10-13,15H2,1-3H3,(H,23,25)/t18-,21-,22-/m0/s1InChIKey
HVCNFRMMBHVNIZ-NYVOZVTQSA-NSynonyms
956807-66-211875427
2((1~(R)4~(a)~(S)8~(a)~(S))1(25dimethoxyphenyl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)~(N)propylacetamide
2((1R)1(25dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)Npropylacetamide
2((1R4aS8aS)1(25dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)Npropylacetamide
956807662
CCCNC(=O)CN1CCC2(C((C@@H)1c1cc(OC)ccc1OC)CCCC2)O
InChI=1SC22H34N2O4c14122320(25)1524131122(26)1065718(22)21(24)171416(272)8919(17)283h8914182126H47101315H213H3(H2325)t182122m0s1
MFCD06764543
ZINC000004064450
ZINC4064450
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