Senna-lax

Base Information

• Chemical Name: Senna-lax
• CAS No.: 66575-30-2
• Deprecated CAS: 73613-07-7
• Molecular Formula: C₄₂H₃₈O₂₀
• Molecular Weight: 862.752
• Nikkaji Number: J182.274H
• Wikidata: Q27116343
• Metabolomics Workbench ID: 70016
• Mol file: 66575-30-2.mol

Synonyms:Pursennid;Senna Glycoside;sennoside;sennoside A and B;sennoside A and B, calcium salt;sennoside A calcium;sennoside A calcium and sennoside B calcium;sennoside A+B calcium;sennoside A, calcium salt;sennoside A, calcium salt (1:1);sennoside b calcium;sennoside B, calcium salt;sennosides;sennosides A and B;sennosides A and B acids;Senokot

Chemical Property of Senna-lax

Chemical Property:

• PSA: 347.96000
• LogP: -1.09560
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 9
• Exact Mass: 862.19564360
• Heavy Atom Count: 62
• Complexity: 1550

Purity/Quality:

99%+, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
• Isomeric SMILES: C1=CC2=C(C(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
• Recent ClinicalTrials: Effectiveness of Docusate in Preventing/Treating Constipation in Palliative Care Patients