Liensinine diperchlorate

Catalog Number	ACM5088904-1
CAS Number	5088-90-4
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.
Molecular Weight	811.66
Molecular Formula	C37H44Cl2N2O14
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
Purity	99%+
Appearance	White to off-white 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
PhysicalState	Powder
Rotatable Bond Count	9
Topological Polar Surface Area	155 Ų

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