Borjatriol
TL;DR: Borjatriol (CAS 56302-41-1) is a chemical compound with molecular formula C20H36O4 and molecular weight 340.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-1-[(3R,4aS,5S,6aS,10aS,10bR)-5-hydroxy-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-3-yl]ethane-1,2-diol
Also Known As: Borjatriol, (-)-Borjatriol, 7,14,15,-Trihydroxy-13-epoxylabdane, 7,14,15,-trihydroxy-13-epoxy-labdane, KST-1A6055
| Molecular Formula | C20H36O4 |
|---|---|
| Molecular Weight | 340.26 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.26135 |
| Heavy Atoms | 24 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 56302-41-1 |
|---|---|
| SMILES | C[C@]12CCCC([C@@H]1C[C@@H]([C@@]3([C@@H]2CC[C@](O3)(C)[C@@H](CO)O)C)O)(C)C |
| InChIKey | YWTBYYFVZRIQQE-OCDWHGDGSA-N |
Product Overview
Borjatriol (CAS 56302-41-1), with molecular formula C20H36O4 and molecular weight 340.26 g/mol. IUPAC: (1R)-1-[(3R,4aS,5S,6aS,10aS,10bR)-5-hydroxy-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-3-yl]ethane-1,2-diol.
Chemical Property Profile of Borjatriol
Property Insights of Borjatriol
The XLogP value of 3.0 indicates that Borjatriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Borjatriol. Following Lipinski's Rule of Five, Borjatriol has 3 hydrogen bond donor(s) and 4 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 Borjatriol?
The CAS number of Borjatriol is 56302-41-1.
What is the molecular formula of Borjatriol?
The molecular formula of Borjatriol is C20H36O4.
What is the molecular weight of Borjatriol?
The molecular weight of Borjatriol is 340.26 g/mol.
Where can I buy Borjatriol?
You can request a quote for Borjatriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Borjatriol?
Yes, KEHONG BIO provides custom synthesis services for Borjatriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.