Vitas-M small molecule compound
2-[(1R,4aS,8aS)-1-(1,3-benzodioxol-5-yl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-N-phenylacetamide
Catalog ID
STL547299
SMILES O=C(Nc1ccccc1)CN1CC[C@@]2([C@H]([C@@H]1c1ccc3c(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 C24H28N2O4 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O4/c27-22(25-18-6-2-1-3-7-18)15-26-13-12-24(28)11-5-4-8-19(24)23(26)17-9-10-20-21(14-17)30-16-29-20/h1-3,6-7,9-10,14,19,23,28H,4-5,8,11-13,15-16H2,(H,25,27)/t19-,23-,24-/m0/s1InChIKey
VGGOQMDLCUWUBS-IGKWTDBASA-NSynonyms
956272-96-111875397
2((1~(R)4~(a)~(S)8~(a)~(S))1(13benzodioxol5yl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)~(N)phenylacetamide
2((1R)1(benzo(d)(13)dioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)Nphenylacetamide
2((1R4aS8aS)1(13benzodioxol5yl)4ahydroxyoctahydroisoquinolin2(1H)yl)Nphenylacetamide
956272961
InChI=1SC24H28N2O4c2722(25186213718)1526131224(28)1154819(24)23(26)179102021(1417)30162920h136791014192328H45811131516H2(H2527)t192324m0s1
MFCD06764510
O=C(Nc1ccccc1)CN1CCC2(C((C@@H)1c1ccc3c(c1)OCO3)CCCC2)O
ZINC000004064048
ZINC4064048
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