18-Hydroxysclareol
TL;DR: 18-Hydroxysclareol (CAS 86248-66-0) is a chemical compound with molecular formula C20H36O3 and molecular weight 324.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,4aR,5S,8aS)-5-(hydroxymethyl)-1-(3-hydroxy-3-methylpent-4-enyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
Also Known As: 18-Hydroxysclareol, (1R,2S,4aR,5S,8aS)-5-(hydroxymethyl)-1-(3-hydroxy-3-methylpent-4-enyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol, (1R,2S,4aR,5S,8aS)-5-(Hydroxymethyl)-1-(3-hydroxy-3-methylpent-4-en-1-yl)-2,5,8a-trimethyldecahydronaphthalen-2-ol, 1-Naphthalenepropanol, alpha-ethenyldecahydro-2-hydroxy-5-(hydroxymethyl)-alpha,2,5,8a-tetramethyl-, (1R-(1alpha(R*),2beta,4abeta,5beta,8aalpha))-, 5-(Hydroxymethyl)-1-(3-hydroxy-3-methylpent-4-en-1-yl)-2,5,8a-trimethyldecahydronaphthalen-2-ol
| Molecular Formula | C20H36O3 |
|---|---|
| Molecular Weight | 324.27 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.26645 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 86248-66-0 |
|---|---|
| SMILES | C[C@@]1(CCC[C@]2([C@H]1CC[C@]([C@@H]2CCC(C)(C=C)O)(C)O)C)CO |
| InChIKey | ZWAHHSLEXAETEF-NJAGWSHESA-N |
Product Overview
18-Hydroxysclareol (CAS 86248-66-0), with molecular formula C20H36O3 and molecular weight 324.27 g/mol. IUPAC: (1R,2S,4aR,5S,8aS)-5-(hydroxymethyl)-1-(3-hydroxy-3-methylpent-4-enyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol.
Chemical Property Profile of 18-Hydroxysclareol
Property Insights of 18-Hydroxysclareol
The XLogP value of 3.5 indicates that 18-Hydroxysclareol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 18-Hydroxysclareol. Following Lipinski's Rule of Five, 18-Hydroxysclareol has 3 hydrogen bond donor(s) and 3 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 18-Hydroxysclareol?
The CAS number of 18-Hydroxysclareol is 86248-66-0.
What is the molecular formula of 18-Hydroxysclareol?
The molecular formula of 18-Hydroxysclareol is C20H36O3.
What is the molecular weight of 18-Hydroxysclareol?
The molecular weight of 18-Hydroxysclareol is 324.27 g/mol.
Where can I buy 18-Hydroxysclareol?
You can request a quote for 18-Hydroxysclareol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 18-Hydroxysclareol?
Yes, KEHONG BIO provides custom synthesis services for 18-Hydroxysclareol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.