Periplocin

Base Information

• Chemical Name: Periplocin
• CAS No.: 13137-64-9
• Molecular Formula: C36H56 O13
• Molecular Weight: 696.82
• European Community (EC) Number: 683-188-2
• UNII: 199X940O3K
• DSSTox Substance ID: DTXSID501030586
• Metabolomics Workbench ID: 199292
• Nikkaji Number: J108.017B
• Wikidata: Q27252090
• Mol file: 13137-64-9.mol

Synonyms:periplocin

Chemical Property of Periplocin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 205°C
• Refractive Index: 1.7500 (estimate)
• Boiling Point: 877.409oC at 760 mmHg
• PKA: 12.89±0.70(Predicted)
• Flash Point: 272.777oC
• PSA: 193.83000
• Density: 1.429g/cm3
• LogP: 1.07850
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Water Solubility.: 7.937g/L(cold water)
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 7
• Exact Mass: 696.37209184
• Heavy Atom Count: 49
• Complexity: 1280

Purity/Quality:

98% ^*data from raw suppliers

Periplocin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O
• Isomeric SMILES: C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O
• Uses: Periplocin can be used to improve bone health to prevent, alleviate, or treat osteoporosis.