Deschloroelatol
TL;DR: Deschloroelatol (CAS 61661-40-3) is a chemical compound with molecular formula C15H23BrO and molecular weight 298.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4R,6R)-4-bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-ol
Also Known As: Deschloroelatol, (+)-Deschloroelatol, Mainly marine derived natural product, (3S,4R,6R)-4-Bromo-5,5,9-trimethyl-1-methylenespiro[5.5]undec-8-en-3-ol, (3S,4R,6R)-4-bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-ol
| Molecular Formula | C15H23BrO |
|---|---|
| Molecular Weight | 298.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 298.09323 |
| Heavy Atoms | 17 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 61661-40-3 |
|---|---|
| SMILES | CC1=CC[C@]2(CC1)C(=C)C[C@@H]([C@@H](C2(C)C)Br)O |
| InChIKey | APALGGYWOOAWLG-YDHLFZDLSA-N |
Product Overview
Deschloroelatol (CAS 61661-40-3), with molecular formula C15H23BrO and molecular weight 298.09 g/mol. IUPAC: (3S,4R,6R)-4-bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-ol.
Chemical Property Profile of Deschloroelatol
Property Insights of Deschloroelatol
The XLogP value of 3.8 indicates that Deschloroelatol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Deschloroelatol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deschloroelatol 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 Deschloroelatol?
The CAS number of Deschloroelatol is 61661-40-3.
What is the molecular formula of Deschloroelatol?
The molecular formula of Deschloroelatol is C15H23BrO.
What is the molecular weight of Deschloroelatol?
The molecular weight of Deschloroelatol is 298.09 g/mol.
Where can I buy Deschloroelatol?
You can request a quote for Deschloroelatol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deschloroelatol?
Yes, KEHONG BIO provides custom synthesis services for Deschloroelatol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.