(+)-Isoliensinine
Isoliensinine · (+)-Isoliensinin · (+)-Isoliensinine · Isoliensinine USP/EP/BP · isoliensinine, lotusine · Isoliensinine, 10 mM in DMSO · (1R)-1-(4-hydroxy-3-{[(1R)-6-methoxy-1-(4-methoxybenzyl)-2-m... · (R)-1-(4-Hydroxy-3-(((R)-6-methoxy-1-(4-methoxybenzyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl)oxy)benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
Identifikatoren & physikalische Daten
| CAS No. | 6817-41-0 |
|---|---|
| Summenformel | C37H42N2O6 |
| Durchschnittliche Molmasse | 610,7 g/mol |
| Monoisotopische Masse | 610,30428706 g/mol |
| SMILES | COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(O)c(OC)cc6CCN5C)ccc4O)c(OC)cc3CCN2C)cc1 |
| InChIKey | AJPXZTKPPINUKN-FIRIVFDPSA-N |
| PubChem CID | 5274591 |
| ChEMBL | CHEMBL502370 |
| ChEBI | CHEBI:185701 |
| DTXSID | DTXSID60218346 |
Chemische & physikalische Eigenschaften
| XLogP | 6,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 83,9 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 8 |
| Frei drehbare Bindungen | 9 |
| Schwere Atome | 45 |
| Formalladung | 0 |
| Komplexität | 917 |
| Schmelzpunkt | 69-71℃ |
| Siedepunkt | 723.1±60.0 °C(Predicted) |
| Dichte | 1.218 |
| Lagerbedingungen | 2-8°C(protect from light) |
| Löslichkeit | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. |
| Aggregatzustand | powder |
| pKa (Säurekonstante) | 9.28±0.45(Predicted) |
| Farbe | White |
Sicherheit & Vorschriften
| Alarmwort | Warnung |
|---|---|
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Beschreibung
Tomita and his co-workers have obtained this bisisoquinoline alkaloid from the embryo of the seeds of Nelumbo nucifera Gaertn. The base has [α]29D + 49.3° (Me2CO) and - 43.3° (CHC13 ). The hydrochloride tetrahydrate forms colourless crystals, m.p. l85-6°C (dry); the perchlorate monohydrate has m.p. 200-3°C (dry); [α]22D - 70° (Me2CO) and the styphnate of the O,O-dimethyl ether, also crystalline, has m.p. l33-5°C; [α]27D - 81.5° (Me2CO). Three methoxyl, two hydroxyl and two methylimino groups are present.
Verwenden
(+)-Isoliensinine is an alkaloid which displays activation of AMP-activated kinase and regulation of PPARγ receptors.