Bullatalicin
TL;DR: Bullatalicin (CAS 129138-51-8) is a chemical compound with molecular formula C37H66O8 and molecular weight 638.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[9-[5-[1,4-dihydroxy-4-[5-(1-hydroxyundecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxynonyl]-2-methyl-2H-furan-5-one
Also Known As: Bullatalicin, Bullatanocin, Squamostatin C, Crassiflorin, Purpureacin 1
| Molecular Formula | C37H66O8 |
|---|---|
| Molecular Weight | 638.48 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Exact Mass | 638.47577 |
| Heavy Atoms | 45 |
| Complexity | 833.0 |
| Melting Point | 107 - 109 °C |
Chemical Identifiers
| CAS Number | 129138-51-8 |
|---|---|
| SMILES | CCCCCCCCCCC(C1CCC(O1)C(CCC(C2CCC(O2)CCCCCCCC(CC3=CC(OC3=O)C)O)O)O)O |
| InChIKey | HKMBLJVHVBJAIH-UHFFFAOYSA-N |
Product Overview
Bullatalicin (CAS 129138-51-8), with molecular formula C37H66O8 and molecular weight 638.48 g/mol. IUPAC: 4-[9-[5-[1,4-dihydroxy-4-[5-(1-hydroxyundecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxynonyl]-2-methyl-2H-furan-5-one.
Chemical Property Profile of Bullatalicin
Property Insights of Bullatalicin
The XLogP value of 8.2 indicates that Bullatalicin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bullatalicin. Following Lipinski's Rule of Five, Bullatalicin has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bullatalicin?
The CAS number of Bullatalicin is 129138-51-8.
What is the molecular formula of Bullatalicin?
The molecular formula of Bullatalicin is C37H66O8.
What is the molecular weight of Bullatalicin?
The molecular weight of Bullatalicin is 638.48 g/mol.
Where can I buy Bullatalicin?
You can request a quote for Bullatalicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bullatalicin?
Yes, KEHONG BIO provides custom synthesis services for Bullatalicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.