4-Hydroxy-25-desoxyneorollinicin
TL;DR: 4-Hydroxy-25-desoxyneorollinicin (CAS 123123-32-0) is a chemical compound with molecular formula C37H66O7 and molecular weight 622.48083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2,13-dihydroxy-13-[5-[5-(1-hydroxyundecyl)oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
Also Known As: Asimicin, Trilobacin, Bullatacin, Annonin VI, rolliniastatin
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C37H66O7 |
| Molecular Weight | 622.48083 g/mol |
| XLogP | 9.7 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 25 |
| Exact Mass | 622.48083 Da |
| Heavy Atoms | 44 |
| Complexity | 801.0 |
| SMILES | CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCC(CC3=CC(OC3=O)C)O)O)O |
| InChIKey | MBABCNBNDNGODA-UHFFFAOYSA-N |
Chemical Property Profile of 4-Hydroxy-25-desoxyneorollinicin
Property Insights of 4-Hydroxy-25-desoxyneorollinicin
The XLogP value of 9.7 indicates that 4-Hydroxy-25-desoxyneorollinicin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-25-desoxyneorollinicin. Following Lipinski's Rule of Five, 4-Hydroxy-25-desoxyneorollinicin has 3 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 4-Hydroxy-25-desoxyneorollinicin?
The CAS number of 4-Hydroxy-25-desoxyneorollinicin is 123123-32-0.
What is the molecular formula of 4-Hydroxy-25-desoxyneorollinicin?
The molecular formula of 4-Hydroxy-25-desoxyneorollinicin is C37H66O7.
What is the molecular weight of 4-Hydroxy-25-desoxyneorollinicin?
The molecular weight of 4-Hydroxy-25-desoxyneorollinicin is 622.48083 g/mol.
Where can I buy 4-Hydroxy-25-desoxyneorollinicin?
You can request a quote for 4-Hydroxy-25-desoxyneorollinicin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Hydroxy-25-desoxyneorollinicin?
Yes, CoreyChem provides custom synthesis services for 4-Hydroxy-25-desoxyneorollinicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.