(3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol
TL;DR: (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol (CAS 18374-83-9) is a chemical compound with molecular formula C15H26O2 and molecular weight 238.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,7R,9S,11R)-2,6,6,9-tetramethyltricyclo[5.4.0.02,9]undecane-8,11-diol
Also Known As: Culmorin, KST-1A3393, (1S,2R,7R,9S,11R)-2,6,6,9-Tetramethyltricyclo[5.4.0.02,9]undecane-8,11-diol, (1s,3r,3as,4r,8ar)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulene-3,9-diol, (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol
| Molecular Formula | C15H26O2 |
|---|---|
| Molecular Weight | 238.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.19328 |
| Heavy Atoms | 17 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 18374-83-9 |
|---|---|
| SMILES | C[C@@]12CCCC([C@H]3[C@@H]1[C@@H](C[C@@]2(C3O)C)O)(C)C |
| InChIKey | VWMGBHVRRNKOAE-PDMNRUCYSA-N |
Product Overview
(3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol (CAS 18374-83-9), with molecular formula C15H26O2 and molecular weight 238.19 g/mol. IUPAC: (1S,2R,7R,9S,11R)-2,6,6,9-tetramethyltricyclo[5.4.0.02,9]undecane-8,11-diol.
Chemical Property Profile of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol
Property Insights of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol
The XLogP value of 3.3 indicates that (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol has 2 hydrogen bond donor(s) and 2 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 (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol?
The CAS number of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol is 18374-83-9.
What is the molecular formula of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol?
The molecular formula of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol is C15H26O2.
What is the molecular weight of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol?
The molecular weight of (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol is 238.19 g/mol.
Where can I buy (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol?
You can request a quote for (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol?
Yes, KEHONG BIO provides custom synthesis services for (3R,3aS,4R,8aR)-1,5,5,8a-Tetramethyldecahydro-1,4-methanoazulene-3,9-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.