Hydroxybersamagenin 1,5-orthoacetate
TL;DR: Hydroxybersamagenin 1,5-orthoacetate (CAS 35609-28-0) is a chemical compound with molecular formula C26H34O7 and molecular weight 458.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5,7-dihydroxy-9,13,16-trimethyl-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosan-8-yl)pyran-2-one
Also Known As: HYDROXYBERSAMAGENIN 1,5-ORTHOACETATE, 5-(5,7-Dihydroxy-9,13,16-trimethyl-15,17,20-trioxahexacyclo[14.3.1.1~14,18~.0~1,13~.0~4,12~.0~5,9~]henicosan-8-yl)-2H-pyran-2-one
| Molecular Formula | C26H34O7 |
|---|---|
| Molecular Weight | 458.23 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 458.23044 |
| Heavy Atoms | 33 |
| Complexity | 991.0 |
Chemical Identifiers
| CAS Number | 35609-28-0 |
|---|---|
| SMILES | CC12CCC3C(C1(CC(C2C4=COC(=O)C=C4)O)O)CCC56C3(C7CC(C5)OC(O7)(O6)C)C |
| InChIKey | OBJNGSFPVMJDQZ-UHFFFAOYSA-N |
Product Overview
Hydroxybersamagenin 1,5-orthoacetate (CAS 35609-28-0), with molecular formula C26H34O7 and molecular weight 458.23 g/mol. IUPAC: 5-(5,7-dihydroxy-9,13,16-trimethyl-15,17,20-trioxahexacyclo[14.3.1.114,18.01,13.04,12.05,9]henicosan-8-yl)pyran-2-one.
Chemical Property Profile of Hydroxybersamagenin 1,5-orthoacetate
Property Insights of Hydroxybersamagenin 1,5-orthoacetate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxybersamagenin 1,5-orthoacetate. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxybersamagenin 1,5-orthoacetate. Following Lipinski's Rule of Five, Hydroxybersamagenin 1,5-orthoacetate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydroxybersamagenin 1,5-orthoacetate?
The CAS number of Hydroxybersamagenin 1,5-orthoacetate is 35609-28-0.
What is the molecular formula of Hydroxybersamagenin 1,5-orthoacetate?
The molecular formula of Hydroxybersamagenin 1,5-orthoacetate is C26H34O7.
What is the molecular weight of Hydroxybersamagenin 1,5-orthoacetate?
The molecular weight of Hydroxybersamagenin 1,5-orthoacetate is 458.23 g/mol.
Where can I buy Hydroxybersamagenin 1,5-orthoacetate?
You can request a quote for Hydroxybersamagenin 1,5-orthoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxybersamagenin 1,5-orthoacetate?
Yes, KEHONG BIO provides custom synthesis services for Hydroxybersamagenin 1,5-orthoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.