Vitas-M small molecule compound
N-benzyl-2-[(1R,4aS,8aS)-1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetamide
Catalog ID
STL546873
SMILES COc1cc(OC)ccc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)CC(=O)NCc1ccccc1
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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 C26H34N2O4 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O4/c1-31-20-11-12-21(23(16-20)32-2)25-22-10-6-7-13-26(22,30)14-15-28(25)18-24(29)27-17-19-8-4-3-5-9-19/h3-5,8-9,11-12,16,22,25,30H,6-7,10,13-15,17-18H2,1-2H3,(H,27,29)/t22-,25-,26-/m0/s1InChIKey
AVRNXAYFHJFLFS-HRNNMHKYSA-NSynonyms
956932-72-216399241
2((1~(R)4~(a)~(S)8~(a)~(S))1(24dimethoxyphenyl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)~(N)benzylacetamide
956932722
COc1cc(OC)ccc1(C@@H)1N(CCC2(C1CCCC2)O)CC(=O)NCc1ccccc1
InChI=1SC26H34N2O4c13120111221(23(1620)322)252210671326(2230)141528(25)1824(29)2717198435919h3589111216222530H671013151718H212H3(H2729)t222526m0s1
MFCD06764332
Nbenzyl2((1R)1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)acetamide
Nbenzyl2((1R4aS8aS)1(24dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)acetamide
ZINC000012662399
ZINC12662399
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