Clinoposaponin IX
TL;DR: Clinoposaponin IX (CAS 159121-99-0) is a chemical compound with molecular formula C36H58O9 and molecular weight 634.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-[[(2R,4S,5R,13S,18S)-2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Clinoposaponin IX, Saikogenin F 3-glucoside, Saikogenin F 3-beta-D-glucoside, (2R,3R,4S,5S,6R)-2-[[(2R,4S,5R,13S,18S)-2-Hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol, 13,28-Epoxy-16,23-dihydroxyolean-11-en-3-yl-D-glucopyranoside
| Molecular Formula | C36H58O9 |
|---|---|
| Molecular Weight | 634.41 g/mol |
| LogP | 2.9251 |
| Topological Polar Surface Area | 149.07 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 634.4081 |
| Heavy Atoms | 45 |
| Complexity | 1206.9054 |
Chemical Identifiers
| CAS Number | 159121-99-0 |
|---|---|
| SMILES | C[C@]12CCC(C(C1CC[C@@]3(C2C=CC45[C@]3(C[C@H](C6([C@@H]4CC(CC6)(C)C)CO5)O)C)C)(C)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O |
Product Overview
Clinoposaponin IX (CAS 159121-99-0), with molecular formula C36H58O9 and molecular weight 634.41 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[[(2R,4S,5R,13S,18S)-2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Clinoposaponin IX
Property Insights of Clinoposaponin IX
The XLogP value of 2.9251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Clinoposaponin IX. The TPSA of 149.07 Ų indicates high polarity, suggesting Clinoposaponin IX may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Clinoposaponin IX has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clinoposaponin IX?
The CAS number of Clinoposaponin IX is 159121-99-0.
What is the molecular formula of Clinoposaponin IX?
The molecular formula of Clinoposaponin IX is C36H58O9.
What is the molecular weight of Clinoposaponin IX?
The molecular weight of Clinoposaponin IX is 634.41 g/mol.
Where can I buy Clinoposaponin IX?
You can request a quote for Clinoposaponin IX directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clinoposaponin IX?
Yes, KEHONG BIO provides custom synthesis services for Clinoposaponin IX and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.