Liensinine diperchlorate

• CAS: 5088-90-4
• Catalog Number: ACM5088904
• Category: Inhibitors
• Molecular Weight: 711.2
• Molecular Formula: C37H44Cl2N2O14
• Description: Liensinine Diperchlor ate is a major isoquinoline alkaloid, extracted from the seed embryo of Nelumbo nucifera Gaertn. Liensinine Diperchlor ate inhibits late-stage autophagy/mitophagy through blocking autophagosome-lysosome fusion. Liensinine Diperchlor ate has a wide range of biological activities, including anti-arrhythmias, anti-hypertension, anti-pulmonary fibrosis, relaxation on vascular smooth muscle, etc.
• Canonical SMILES: O=Cl(=O)(O)=O.CN1[C@@H](C2=CC(OC3=CC(C[C@@H]4C5=CC(OC)=C(OC)C=C5CCN4C)=CC=C3O)=C(OC)C=C2CC1)CC6=CC=C(O)C=C6.O=Cl(=O)(O)=O
• InChI: InChI=1S/C37H42N2O6.ClHO4/c1-38-14-13-26-20-35(43-4)37(22-29(26)30(38)16-23-6-9-27(40)10-7-23)45-33-18-24(8-11-32(33)41)17-31-28-21-36(44-5)34(42-3)19-25(28)12-15-39(31)2;2-1(3,4)5/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3;(H,2,3,4,5)/t30-,31-;/m1./s1
• InChI Key: SBJXHMBOBQYZFA-XBPPRYKJSA-N
• Appearance: Solid
• Storage: 4°C, sealed storage, away from moisture*In solvent : -80°C, 6 months; -20°C, 1 month (sealed storage, away from moisture).
• Complexity: 1030
• Covalently-Bonded Unit Count: 2
• Defined Atom Stereocenter Count: 2
• Exact Mass: 710.2606233
• Heavy Atom Count: 50
• Hydrogen Bond Acceptor Count: 12
• Hydrogen Bond Donor Count: 3
• Isomeric SMILES: CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC.OCl(=O)(=O)=O
• Monoisotopic Mass: 710.2606233
• Physical State: Powder
• Rotatable Bond Count: 9
• Shipping: Can be shipped at room temperature, where not in use may vary.
• Source: PlantsNymphaeaceaeNelumbo nucifera Gaertn.
• Topological Polar Surface Area: 155 Ų