7-Megastigmene-3,5,6,9-tetraol
TL;DR: 7-Megastigmene-3,5,6,9-tetraol (CAS 276870-26-9) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,4S)-1-[(E,3S)-3-hydroxybut-1-enyl]-2,6,6-trimethylcyclohexane-1,2,4-triol
Also Known As: Megastigmane, 7-Megastigmene-3,5,6,9-tetraol, 7-Megastigmene-3,5,6,9-tetrol, Megastigm-7-ene-3,5,6,9-tetraol, J3.332.135J
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 276870-26-9 |
|---|---|
| SMILES | C[C@@H](/C=C/[C@@]1([C@](C[C@H](CC1(C)C)O)(C)O)O)O |
| InChIKey | CTCKPFXFWVNGLG-DWFSUXBBSA-N |
Product Overview
7-Megastigmene-3,5,6,9-tetraol (CAS 276870-26-9), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: (1R,2R,4S)-1-[(E,3S)-3-hydroxybut-1-enyl]-2,6,6-trimethylcyclohexane-1,2,4-triol.
Chemical Property Profile of 7-Megastigmene-3,5,6,9-tetraol
Property Insights of 7-Megastigmene-3,5,6,9-tetraol
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Megastigmene-3,5,6,9-tetraol. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Megastigmene-3,5,6,9-tetraol. Following Lipinski's Rule of Five, 7-Megastigmene-3,5,6,9-tetraol has 4 hydrogen bond donor(s) and 4 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 7-Megastigmene-3,5,6,9-tetraol?
The CAS number of 7-Megastigmene-3,5,6,9-tetraol is 276870-26-9.
What is the molecular formula of 7-Megastigmene-3,5,6,9-tetraol?
The molecular formula of 7-Megastigmene-3,5,6,9-tetraol is C13H24O4.
What is the molecular weight of 7-Megastigmene-3,5,6,9-tetraol?
The molecular weight of 7-Megastigmene-3,5,6,9-tetraol is 244.17 g/mol.
Where can I buy 7-Megastigmene-3,5,6,9-tetraol?
You can request a quote for 7-Megastigmene-3,5,6,9-tetraol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Megastigmene-3,5,6,9-tetraol?
Yes, KEHONG BIO provides custom synthesis services for 7-Megastigmene-3,5,6,9-tetraol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.