Ophiobolin H

Base Information

• Chemical Name: Ophiobolin H
• CAS No.: 90108-64-8
• Molecular Formula: C₂₅H₃₈O₃
• Molecular Weight: 386.575
• Hs Code.: 29419000
• UNII: X45XMT37B3
• Wikidata: Q105110783
• ChEMBL ID: CHEMBL4526980
• Mol file: 90108-64-8.mol

Synonyms:Ophiobolin-H;Ophiobolin H;X45XMT37B3;CHEMBL4526980;Ophiobola-7,17,19-triene-3,5-diol, 5,25-epoxy-, (17Z)-;(1R,2aS,6aS,7R,9aR,10aS,10bS)-7-((1S,2Z)-1,5-Dimethyl-2,4-hexadien-1-yl)-1,2,4,6,6a,7,8,9,9a,10,10a,10b-dodecahydro-1,9a-dimethyl-2ah-3-oxacyclopenta(5,6)cycloocta(1,2,3-cd)pentalene-1,2a-diol;2Ah-3-oxacyclopenta(5,6)cycloocta(1,2,3-cd)pentalene-1,2a-diol, 7-((1S,2Z)-1,5-dimethyl-2,4-hexadien-1-yl)-1,2,4,6,6a,7,8,9,9a,10,10a,10b-dodecahydro-1,9a-dimethyl-, (1R,2aS,6aS,7R,9aR,10aS,10bS)-;UNII-X45XMT37B3;BDBM50523066

Chemical Property of Ophiobolin H

Chemical Property:

• PSA: 49.69000
• LogP: 5.00350
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 386.28209507
• Heavy Atom Count: 28
• Complexity: 717

Purity/Quality:

98% ^*data from raw suppliers

OPHIOBOLIN-H 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C=CC=C(C)C)C1CCC2(C1CC=C3COC4(C3C(C2)C(C4)(C)O)O)C
• Isomeric SMILES: C[C@@H](/C=C\C=C(C)C)[C@H]1CC[C@]2([C@H]1C/C=C\3/CO[C@@]4([C@H]3[C@H](C2)[C@](C4)(C)O)O)C

Technology Process of Ophiobolin H

There total 1 articles about Ophiobolin H 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:

ophiobolin K (138057-90-6,138128-31-1) → ophiobolin H (90108-64-8)

Guidance literature:

With sodium tetrahydroborate; In ethanol; at 0 ℃; for 0.5h;

DOI:10.1016/j.tet.2004.05.021

upstream raw materials:

ophiobolin K

Refernces