Soyasaponin VI

Base Information

• Chemical Name: Soyasaponin VI
• CAS No.: 143519-54-4
• Molecular Formula: C54H84 O21
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID701317271
• Wikidata: Q105194559
• Mol file: 143519-54-4.mol

Synonyms:3-O-(rhamnopyranosyl-1-2-galactopyranosyl-1-2-glucuronopyranosyl-1-)-22-O-(3'-hydroxy-2'-methyl-5',6'-dihydro-4'-pyrone-6'-)-3,22,24-trihydroxyolean-12-ene;chromosaponin I

Chemical Property of Soyasaponin VI

Chemical Property:

• Boiling Point: °Cat760mmHg
• PKA: 2.76±0.70(Predicted)
• Flash Point: °C
• PSA: 330.51000
• Density: 1.43g/cm³
• LogP: 1.83390
• XLogP3: 3
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 21
• Rotatable Bond Count: 11
• Exact Mass: 1068.55050968
• Heavy Atom Count: 75
• Complexity: 2210

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8OC9CC(=O)C(=C(O9)C)O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O
• Isomeric SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2O[C@@H]3[C@H]([C@@H]([C@H](O[C@H]3O[C@H]4CC[C@]5([C@H]([C@@]4(C)CO)CC[C@@]6([C@@H]5CC=C7[C@]6(CC[C@@]8([C@H]7CC(C[C@H]8O[C@H]9CC(=O)C(=C(O9)C)O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O
• Uses: Soyasaponin VI is used in method for producing soya saponins.