Longispinogenin

Base Information

• Chemical Name: Longispinogenin
• CAS No.: 465-94-1
• Molecular Formula: C₃₀H₅₀O₃
• Molecular Weight: 458.725
• UNII: 71XG0082E9
• Nikkaji Number: J12.088J
• Wikidata: Q27265993
• Mol file: 465-94-1.mol

Synonyms:Longispinogenin;UNII-71XG0082E9;LONGISPINOGEN;465-94-1;71XG0082E9;(3S,4aR,5R,6aR,6bS,8S,8aR,12aS,14aR,14bR)-8,8a-Bis-hydroxymethyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-ol;Picen-3-ol, 8,8a-bis-hydroxymethyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-, (3S,4aR,5R,6aR,6bS,8S,8aR,12aS,14aR,14bR);Olean-12-ene-3, 16 28-triol, (3beta,16beta)-;Olean-12-ene-3,16,28-triol, (3beta,16beta)-;(3S,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol;SCHEMBL179854;AKOS040752666;HY-133805;OLEAN-12-ENE-3beta,16beta,28-TRIOL;CS-0133352;OLEAN-12-ENE-3.BETA.,16.BETA.,28-TRIOL;Q27265993

Chemical Property of Longispinogenin

Chemical Property:

• Vapor Pressure: 5.76E-15mmHg at 25°C
• Boiling Point: 561.9°Cat760mmHg
• Flash Point: 226.6°C
• PSA: 60.69000
• Density: 1.09g/cm³
• LogP: 6.35970
• XLogP3: 7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 458.37599545
• Heavy Atom Count: 33
• Complexity: 844

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C)O)C)CO)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)CO)O)C)C)(C)C)O

Technology Process of Longispinogenin

There total 4 articles about Longispinogenin 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:

Corchorusin A (61846-58-0,77537-94-1,108886-06-2) → D-Galactose (59-23-4) + longispinogenin (465-94-1,465-95-2)

Guidance literature:

With hydrogenchloride; In methanol; water; for 4h;

Reference yield:

→ 3β,16,28-Trihydroxyolean-12-en (465-94-1,465-95-2)

Guidance literature:

Lacton 16, LiAlH4/BF3*Et2O;

DOI:10.1021/jo00931a046

Reference yield:

→ Longispinogenin (465-94-1,465-95-2)

Guidance literature:

Saponin Sapogenol aus Primula sieboldi, 2N HCl, EtOH, Hydrolyse;

upstream raw materials:

Corchorusin A