Schidigerasaponin D5

Base Information

• Chemical Name: Schidigerasaponin D5
• CAS No.: 41059-79-4
• Molecular Formula: C₃₉H₆₄O₁₃
• Molecular Weight: 740.929
• European Community (EC) Number: 683-217-9
• Wikidata: Q105168067
• Mol file: 41059-79-4.mol

Synonyms:timosaponin A3;timosaponin AIII

Chemical Property of Schidigerasaponin D5

Chemical Property:

• Melting Point: 317-322 °C
• Refractive Index: 1.606
• Boiling Point: 862.844 °C at 760 mmHg
• PKA: 12.85±0.70(Predicted)
• Flash Point: 475.631 °C
• PSA: 196.99000
• Density: 1.366 g/cm³
• LogP: 1.44220
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 6
• Exact Mass: 740.43469209
• Heavy Atom Count: 52
• Complexity: 1270

Purity/Quality:

98% ^*data from raw suppliers

Timosaponin A3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1
• Uses: Timosaponin A3 suppresses certain human tumor processes and has the potential to be developed as an anticancer agent. Reverses multi-drug resistance in human chronic myelogenous leukemia K562/ADM cells via downregulation of MDR1 and MRP1 expression by inhibiting PI3K/Akt signaling pathway. Induction of mitochondrial-dependent apoptosis in HepG2 human hepatocellular carcinoma cells.Timosaponin A3 is a potent inhibitor of U46619, that induces rat platelet aggregation and exhibited superior selectivity for the TP receptor vs. other G protein-coupled receptors and a PKC activator.

Technology Process of Schidigerasaponin D5

There total 1 articles about Schidigerasaponin D5 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

C53H78O20 (107800-07-7,148695-14-1) → melongoside E (41059-79-4,84633-33-0,94805-84-2,95722-22-8,122566-56-7,138831-68-2,149817-67-4)

Guidance literature:

With sodium hydroxide; In methanol; at 100 ℃; for 4h;

DOI:10.1007/BF00580069

Reference yield:

saponin A (41059-79-4,84633-33-0,94805-84-2,95722-22-8,122566-56-7,138831-68-2,149817-67-4) → tigogenin (77-60-1,126-18-1,126-19-2,428-41-1,470-00-8,470-01-9,470-03-1,546-41-8,6788-40-5,7050-46-6,16653-88-6,19043-98-2,20460-38-2,31356-48-6,36027-61-9,36136-35-3,75172-34-8,78964-18-8,82597-74-8,107380-02-9,119677-72-4)

Guidance literature:

With hydrogenchloride; In methanol; for 3h; Heating;

DOI:10.1016/0031-9422(90)89070-P

Reference yield:

melongoside E (41059-79-4,84633-33-0,94805-84-2,95722-22-8,122566-56-7,138831-68-2,149817-67-4) → melongoside A (14835-43-9,29685-52-7,31217-07-9,35068-81-6,35959-24-1,63163-00-8,68422-00-4,70954-49-3,75657-39-5)

Guidance literature:

With sulfuric acid; In methanol; for 1.5h;

DOI:10.1007/BF00580069

upstream raw materials:

C₅₃H₇₈O₂₀

Downstream raw materials:

tigogenin

melongoside A

Refernces