Vitas-M small molecule compound
1-[1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-phenylpropan-1-one
Catalog ID
STL512278
SMILES COc1cc(OC)ccc1C1N(CCC2(C1CCCC2)O)C(=O)CCc1ccccc1
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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 C26H33NO4 MW 423.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO4/c1-30-20-12-13-21(23(18-20)31-2)25-22-10-6-7-15-26(22,29)16-17-27(25)24(28)14-11-19-8-4-3-5-9-19/h3-5,8-9,12-13,18,22,25,29H,6-7,10-11,14-17H2,1-2H3InChIKey
LXBRFSSHLGAUPU-UHFFFAOYSA-NSynonyms
1((1R)1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3phenylpropan1one
1(1(24dimethoxyphenyl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3phenylpropan1one
1(1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3phenylpropan1one
3768387
COc1cc(OC)ccc1(C@@H)1N(CCC2(C1CCCC2)O)C(=O)CCc1ccccc1
InChI=1SC26H33NO4c13020121321(23(1820)312)252210671526(2229)161727(25)24(28)1411198435919h3589121318222529H6710111417H212H3
MFCD04146807
ZINC000002107633
ZINC000015953798
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