Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-3,7,15-trihydroxy-, (3alpha,4beta,7beta)-

Base Information

• Chemical Name: Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-3,7,15-trihydroxy-, (3alpha,4beta,7beta)-
• CAS No.: 23255-69-8
• Molecular Formula: C₁₇H₂₂O₈
• Molecular Weight: 354.357
• Hs Code.: 2932990090
• European Community (EC) Number: 621-752-1
• DSSTox Substance ID: DTXSID1020649
• Mol file: 23255-69-8.mol

Synonyms:fusarenon-X

Chemical Property of Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-3,7,15-trihydroxy-, (3alpha,4beta,7beta)-

Chemical Property:

• Vapor Pressure: 2.51E-15mmHg at 25°C
• Melting Point: 91-92℃
• Refractive Index: 1.4430 (estimate)
• Boiling Point: 569.2°Cat760mmHg
• PKA: 11.70±0.70(Predicted)
• Flash Point: 208.4°C
• PSA: 125.82000
• Density: 1.5g/cm³
• LogP: -1.29610
• Storage Temp.: −20°C
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 354.13146766
• Heavy Atom Count: 25
• Complexity: 688

Purity/Quality:

Fusarenon X ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,Xn,T+
• Hazard Codes: F,Xn,T+
• Statements: 11-20/21/22-36-36/37/38-28
• Safety Statements: 26-36/37-45-36/37/39-22-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Biological Agents -> Mycotoxins
• Canonical SMILES: CC1=CC2C(C(C1=O)O)(C3(C(C(C(C34CO4)O2)O)OC(=O)C)C)CO
• Isomeric SMILES: CC1=CC2[C@@](C(C1=O)O)([C@]3([C@@H]([C@H](C([C@@]34CO4)O2)O)OC(=O)C)C)CO
• Description: Fusarenon X is a type B trichothecene mycotoxin typically derived from Fusarium species. It is primarily found in contaminated cereals. Fusarenon X inhibits protein synthesis, which leads to disruption of DNA synthesis. As this occurs in actively proliferating cells, fusarenon X causes immunosuppression, intestinal malabsorption, developmental toxicity, and genotoxicity. Fusarenon X can be metabolized to fusarenon X-glucoside by infected plants.
• Uses: A mycotoxin produced by Fusarium, having immunosuppressive and carcinogenic properties.

Technology Process of Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-3,7,15-trihydroxy-, (3alpha,4beta,7beta)-

There total 2 articles about Trichothec-9-en-8-one, 4-(acetyloxy)-12,13-epoxy-3,7,15-trihydroxy-, (3alpha,4beta,7beta)- 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:

→ Fusarenon (23255-69-8)

Guidance literature:

aus Diacetat II (R¹=OH, R²=R³=Ac, R⁴=H);

DOI:10.1039/C2969001266b

Reference yield:

→ Fusarenon X (23255-69-8)

Guidance literature:

Enon I (R1=R4=H,R2=R3=COCH3), NH4OH/Me.;

DOI:10.1039/j39700000375