Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-
TL;DR: Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- (CAS 131180-26-2) is a chemical compound with molecular formula C33H50O7 and molecular weight 558.35565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R,2R,3S,7R,9R,10R)-3-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] (9E,12Z)-octadeca-9,12-dienoate
Also Known As: Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-
Technical Specifications
| Molecular Formula | C33H50O7 |
| Molecular Weight | 558.35565 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 17 |
| Exact Mass | 558.35565 Da |
| Heavy Atoms | 40 |
| Complexity | 985.0 |
| SMILES | CCCCC/C=C\C/C=C/CCCCCCCC(=O)O[C@@H]1C[C@@]2([C@@]3([C@@H](C=C(C(=O)[C@H]3O)C)O[C@H]1C24CO4)CO)C |
| InChIKey | OHBWYIQKUJZKGZ-OAJQKCHSSA-N |
Chemical Property Profile of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-
Property Insights of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-
The XLogP value of 6.6 indicates that Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-. Following Lipinski's Rule of Five, Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-?
The CAS number of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- is 131180-26-2.
What is the molecular formula of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-?
The molecular formula of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- is C33H50O7.
What is the molecular weight of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-?
The molecular weight of Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- is 558.35565 g/mol.
Where can I buy Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-?
You can request a quote for Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)-?
Yes, CoreyChem provides custom synthesis services for Trichothec-9-en-8-one, 12,13-epoxy-7,15-dihydroxy-3-((1-oxo-9,12-octadecadienyl)oxy)-, (3alpha(9Z,12Z),7alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.