WF 11605
TL;DR: WF 11605 (CAS 127475-47-2) is a chemical compound with molecular formula C38H60O11 and molecular weight 692.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,4aS,6aR,8R,9R,10aS,12aS)-9-acetyloxy-2,4a,7,7,10a,12a-hexamethyl-2-(3-methylbutan-2-yl)-3-oxo-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4,5,6,6a,8,9,10,11,12-decahydrochrysene-1-carboxylic acid
Also Known As: WF 11605, (1R,2R,4aS,6aR,8R,9R,10aS,12aS)-9-acetyloxy-2,4a,7,7,10a,12a-hexamethyl-2-(3-methylbutan-2-yl)-3-oxo-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4,5,6,6a,8,9,10,11,12-decahydrochrysene-1-carboxylic acid, 9-Acetoxy-2-(1,2-dimethylpropyl)-8-((beta-D-glucopyranosyl)oxy)-1,2,3,4,4a,5,6,6a,7,8,9,10,10a,11,12,12a-hexadecahydro-2,4a,7,7,10a,12a-hexamethyl-3-oxochrysene-1-carboxylic acid, D:C-Friedo-B':A'-neo-19,20-secogammacer-8-en-19-oic acid, 2-(acetyloxy)-3-(hexopyranosyloxy)-16-oxo-, (1R,2R,4aS,6aR,8R,9R,10aS,12aS)-9-(Acetyloxy)-8-(beta-D-glucopyranosyloxy)-2,4a,7,7,10a,12a-hexamethyl-2-(3-methylbutan-2-yl)-3-oxo-1,2,3,4,4a,5,6,6a,7,8,9,10,10a,11,12,12a-hexadecahydrochrysene-1-carboxylic acid
| Molecular Formula | C38H60O11 |
|---|---|
| Molecular Weight | 692.41 g/mol |
| LogP | 4.0244 |
| Topological Polar Surface Area | 180.05 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 692.4136 |
| Heavy Atoms | 49 |
| Complexity | 1370.8206 |
Chemical Identifiers
| CAS Number | 127475-47-2 |
|---|---|
| SMILES | CC(C)C(C)[C@@]1([C@@H]([C@@]2(CCC3=C([C@]2(CC1=O)C)CC[C@@H]4[C@@]3(C[C@H]([C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)OC(=O)C)C)C)C(=O)O)C |
Product Overview
WF 11605 (CAS 127475-47-2), with molecular formula C38H60O11 and molecular weight 692.41 g/mol. IUPAC: (1R,2R,4aS,6aR,8R,9R,10aS,12aS)-9-acetyloxy-2,4a,7,7,10a,12a-hexamethyl-2-(3-methylbutan-2-yl)-3-oxo-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4,5,6,6a,8,9,10,11,12-decahydrochrysene-1-carboxylic acid.
Chemical Property Profile of WF 11605
Property Insights of WF 11605
The XLogP value of 4.0244 indicates that WF 11605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.05 Ų indicates high polarity, suggesting WF 11605 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, WF 11605 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WF 11605?
The CAS number of WF 11605 is 127475-47-2.
What is the molecular formula of WF 11605?
The molecular formula of WF 11605 is C38H60O11.
What is the molecular weight of WF 11605?
The molecular weight of WF 11605 is 692.41 g/mol.
Where can I buy WF 11605?
You can request a quote for WF 11605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WF 11605?
Yes, KEHONG BIO provides custom synthesis services for WF 11605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.