Subergorgiol
TL;DR: Subergorgiol (CAS 444103-23-5) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,5R,8R,9S)-2,5,9-trimethyl-3-tricyclo[6.3.0.01,5]undec-3-enyl]methanol
Also Known As: Subergorgiol, J1.781.971B, [(1S,2S,5R,8R,9S)-2,5,9-trimethyl-3-tricyclo[6.3.0.01,5]undec-3-enyl]methanol, ((1S,2S,5R,8R,9S)-2,5,9-trimethyl-3-tricyclo(6.3.0.01,5)undec-3-enyl)methanol, [(1S,2S,5R,8R,9S)-2,5,9-trimethyltricyclo[6.3.0.01,5]undec-3-en-3-yl]methanol
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 444103-23-5 |
|---|---|
| SMILES | C[C@H]1CC[C@@]23[C@@H]1CC[C@@]2(C=C([C@H]3C)CO)C |
| InChIKey | GJNXTRPTZOVADS-PWRGDLIESA-N |
Product Overview
Subergorgiol (CAS 444103-23-5), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: [(1S,2S,5R,8R,9S)-2,5,9-trimethyl-3-tricyclo[6.3.0.01,5]undec-3-enyl]methanol.
Chemical Property Profile of Subergorgiol
Property Insights of Subergorgiol
The XLogP value of 3.6 indicates that Subergorgiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Subergorgiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Subergorgiol has 1 hydrogen bond donor(s) and 1 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 Subergorgiol?
The CAS number of Subergorgiol is 444103-23-5.
What is the molecular formula of Subergorgiol?
The molecular formula of Subergorgiol is C15H24O.
What is the molecular weight of Subergorgiol?
The molecular weight of Subergorgiol is 220.18 g/mol.
Where can I buy Subergorgiol?
You can request a quote for Subergorgiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Subergorgiol?
Yes, KEHONG BIO provides custom synthesis services for Subergorgiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.