Aldosterone 18-glucuronide
TL;DR: Aldosterone 18-glucuronide (CAS 40786-99-0) is a chemical compound with molecular formula C27H36O11 and molecular weight 536.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2S,14R,16R)-2-(2-hydroxyacetyl)-14-methyl-11-oxo-17-oxapentacyclo[14.2.1.01,5.06,15.09,14]nonadec-9-en-18-yl]oxy]oxane-2-carboxylic acid
Also Known As: Aldosterone 18-glucuronide, Aldosterone-18-D-glucuronoside, Aldosterone-18-D-glucosiduronic acid, Aldosterone-18-delta-glucuronoside, KST-1A4671
| Molecular Formula | C27H36O11 |
|---|---|
| Molecular Weight | 536.23 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 536.22577 |
| Heavy Atoms | 38 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 40786-99-0 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CCC3C2[C@H]4CC5(C3CC[C@@H]5C(=O)CO)C(O4)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O |
| InChIKey | OMRIQCUHVVBJKI-ACOLCOCVSA-N |
Product Overview
Aldosterone 18-glucuronide (CAS 40786-99-0), with molecular formula C27H36O11 and molecular weight 536.23 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2S,14R,16R)-2-(2-hydroxyacetyl)-14-methyl-11-oxo-17-oxapentacyclo[14.2.1.01,5.06,15.09,14]nonadec-9-en-18-yl]oxy]oxane-2-carboxylic acid.
Chemical Property Profile of Aldosterone 18-glucuronide
Property Insights of Aldosterone 18-glucuronide
The XLogP value of -0.1 indicates that Aldosterone 18-glucuronide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 180.0 Ų indicates high polarity, suggesting Aldosterone 18-glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aldosterone 18-glucuronide has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Aldosterone 18-glucuronide?
The CAS number of Aldosterone 18-glucuronide is 40786-99-0.
What is the molecular formula of Aldosterone 18-glucuronide?
The molecular formula of Aldosterone 18-glucuronide is C27H36O11.
What is the molecular weight of Aldosterone 18-glucuronide?
The molecular weight of Aldosterone 18-glucuronide is 536.23 g/mol.
Where can I buy Aldosterone 18-glucuronide?
You can request a quote for Aldosterone 18-glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aldosterone 18-glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Aldosterone 18-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.