Synonym: trans-(1S,2S)-3,4-Dichloro-N-methyl-N-[2-(1-pyrrolidinyl)cyclohexyl]benzeneacetamide hydrochloride hydrate
CAS Number: 114528-79-9 (anhydrous)
Empirical Formula (Hill Notation): C19H26Cl2N2O · HCl · xH2O
Molecular Weight: 405.79 (anhydrous basis)
MDL Number: MFCD11044455
Linear Formula: C19H26Cl2N2O · HCl · xH2O
Product Type: Chemical
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This image depicts U111-5MG.
| assay |
≥98% (HPLC) |
| color |
white |
| form |
solid |
| InChI |
1S/C19H26Cl2N2O.ClH.H2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23;;/h8-9,12,17-18H,2-7,10-11,13H2,1H3;1H;1H2/t17-,18-;;/m0../s1 |
| InChI key |
UWPRPWMHQDPOFR-MPGISEFESA-N |
| optical activity |
[α]22/D -39.0 to -32.0°, c = 0.5 in methanol(lit.) |
| Quality Level |
100  |
| SMILES string |
O.Cl.CN([C@H]1CCCC[C@@H]1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3 |
| solubility |
H2O: 13 mg/mL |
| storage condition |
desiccated |
| storage temp. |
2-8°C |
| Application: |
(−)-trans-(1S,2S)-U-50488 hydrochloride hydrate (U-50488) has been used as a κ-opioid receptor (KOR) agonist has been used to study its effect on the increase of tidal volumes in adult red-eared slider turtles (Trachemys scripta). |
| Biochem/physiol Actions: |
Potent κ opioid receptor agonist; more potent enantiomer of (±)-trans-U-50488. |
| Packaging: |
5, 25, 100 mg in glass bottle |
| Preparation Note: |
(−)-trans-(1S,2S)-U-50488 hydrochloride hydrate is soluble in water at 13 mg/ml. |
| RIDADR |
NONH for all modes of transport |
| WGK Germany |
WGK 3 |
| Flash Point(F) |
Not applicable |
| Flash Point(C) |
Not applicable |
| Purity |
≥98% (HPLC) |
| Storage Temp. |
2-8°C |
| UNSPSC |
12352200 |