Spirosolan-3-ol
TL;DR: Spirosolan-3-ol (CAS 79464-64-5) is a chemical compound with molecular formula C27H45NO2 and molecular weight 415.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]-16-ol
Also Known As: Tomatidine, Tomatidin, Spirosolan-3-ol, Megacarpidine, Megacarpidin
| Molecular Formula | C27H45NO2 |
|---|---|
| Molecular Weight | 415.35 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 415.34503 |
| Heavy Atoms | 30 |
| Complexity | 696.0 |
Chemical Identifiers
| CAS Number | 79464-64-5 |
|---|---|
| SMILES | CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)NC1 |
| InChIKey | XYNPYHXGMWJBLV-UHFFFAOYSA-N |
Product Overview
Spirosolan-3-ol (CAS 79464-64-5), with molecular formula C27H45NO2 and molecular weight 415.35 g/mol. IUPAC: 5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]-16-ol.
Chemical Property Profile of Spirosolan-3-ol
Property Insights of Spirosolan-3-ol
The XLogP value of 6.2 indicates that Spirosolan-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.5 Ų, Spirosolan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spirosolan-3-ol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Spirosolan-3-ol?
The CAS number of Spirosolan-3-ol is 79464-64-5.
What is the molecular formula of Spirosolan-3-ol?
The molecular formula of Spirosolan-3-ol is C27H45NO2.
What is the molecular weight of Spirosolan-3-ol?
The molecular weight of Spirosolan-3-ol is 415.35 g/mol.
Where can I buy Spirosolan-3-ol?
You can request a quote for Spirosolan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spirosolan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for Spirosolan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.