Ecliptasaponin A

Base Information

• Chemical Name: Ecliptasaponin A
• CAS No.: 78285-90-2
• Molecular Formula: C36H58 O9
• Molecular Weight: 634.851
• Hs Code.: 29389090
• European Community (EC) Number: 278-887-0
• DSSTox Substance ID: DTXSID10999638
• Nikkaji Number: J319.751D
• Wikidata: Q105322091
• ChEMBL ID: CHEMBL3343916
• Mol file: 78285-90-2.mol

Synonyms:ecliptasaponin A

Chemical Property of Ecliptasaponin A

Chemical Property:

• Melting Point: 237～238℃
• Boiling Point: 752.6±60.0 °C(Predicted)
• PKA: 4.42±0.70(Predicted)
• Flash Point: 228.6oC
• PSA: 156.91000
• Density: 1.27±0.1 g/cm3 (20 ºC 760 Torr)
• LogP: 4.02860
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 4
• Exact Mass: 634.40808342
• Heavy Atom Count: 45
• Complexity: 1210

Purity/Quality:

98%,99%, ^*data from raw suppliers

Eclalbasaponin II analytical standard ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C)OC6C(C(C(C(O6)CO)O)O)O)C)C(=O)O)C
• Isomeric SMILES: C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O

Technology Process of Ecliptasaponin A

There total 1 articles about Ecliptasaponin A 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:

→ (3β,16α)-3-(β-D-glucopyranosyloxy)-16-hydroxyolean-12-en-28-oic acid (78285-90-2,206756-04-9)

Guidance literature:

schrittweise Hydrolyse von Triacanthosid A(1) und G;

DOI:10.1007/BF00565685