Isobauerenol
TL;DR: Isobauerenol (CAS 22149-71-9) is a chemical compound with molecular formula C30H50O and molecular weight 426.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4aR,6aS,6bS,8aR,11R,12S,12aR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,13,14-tetradecahydro-1H-picen-3-ol
Also Known As: Isobauerenol, (+)-Isobauerenol, 8-BAUEREN-3-OL, Bauera-8-ene-3beta-ol, D:C-Friedours-8-en-3-ol, (3beta)-
| Molecular Formula | C30H50O |
|---|---|
| Molecular Weight | 426.39 g/mol |
| LogP | 8.1689 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 426.38617 |
| Heavy Atoms | 31 |
| Complexity | 792.2334 |
Chemical Identifiers
| CAS Number | 22149-71-9 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2(CC[C@@]3(C4=C(CC[C@]3([C@@H]2[C@H]1C)C)[C@]5(CC[C@@H](C([C@@H]5CC4)(C)C)O)C)C)C |
Product Overview
Isobauerenol (CAS 22149-71-9), with molecular formula C30H50O and molecular weight 426.39 g/mol. IUPAC: (3S,4aR,6aS,6bS,8aR,11R,12S,12aR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,13,14-tetradecahydro-1H-picen-3-ol.
Chemical Property Profile of Isobauerenol
Property Insights of Isobauerenol
The XLogP value of 8.1689 indicates that Isobauerenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, Isobauerenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobauerenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isobauerenol?
The CAS number of Isobauerenol is 22149-71-9.
What is the molecular formula of Isobauerenol?
The molecular formula of Isobauerenol is C30H50O.
What is the molecular weight of Isobauerenol?
The molecular weight of Isobauerenol is 426.39 g/mol.
Where can I buy Isobauerenol?
You can request a quote for Isobauerenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobauerenol?
Yes, KEHONG BIO provides custom synthesis services for Isobauerenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.