Triiodothyronine glucuronide
TL;DR: Triiodothyronine glucuronide (CAS 29919-72-0) is a chemical compound with molecular formula C21H20I3NO10 and molecular weight 826.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-[4-[4-[(2S)-2-amino-2-carboxyethyl]-2,6-diiodophenoxy]-2-iodophenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Triiodothyronine glucuronide, triiodothyronineglucuronide, Triiodothyronine glucuronoside, 3,5,3'-Triiodothyronine glucuronide, 3,3',5-Triiodo-L-thyronine 4'-O-beta-D-glucuronide
| Molecular Formula | C21H20I3NO10 |
|---|---|
| Molecular Weight | 826.82 g/mol |
| LogP | 1.5181 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 826.8221 |
| Heavy Atoms | 35 |
| Complexity | 1093.7483 |
Chemical Identifiers
| CAS Number | 29919-72-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1OC2=C(C=C(C=C2I)C[C@@H](C(=O)O)N)I)I)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
Product Overview
Triiodothyronine glucuronide (CAS 29919-72-0), with molecular formula C21H20I3NO10 and molecular weight 826.82 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-[4-[4-[(2S)-2-amino-2-carboxyethyl]-2,6-diiodophenoxy]-2-iodophenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of Triiodothyronine glucuronide
Property Insights of Triiodothyronine glucuronide
The XLogP value of 1.5181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triiodothyronine glucuronide. The TPSA of 189.0 Ų indicates high polarity, suggesting Triiodothyronine glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Triiodothyronine glucuronide 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 Triiodothyronine glucuronide?
The CAS number of Triiodothyronine glucuronide is 29919-72-0.
What is the molecular formula of Triiodothyronine glucuronide?
The molecular formula of Triiodothyronine glucuronide is C21H20I3NO10.
What is the molecular weight of Triiodothyronine glucuronide?
The molecular weight of Triiodothyronine glucuronide is 826.82 g/mol.
Where can I buy Triiodothyronine glucuronide?
You can request a quote for Triiodothyronine glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triiodothyronine glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Triiodothyronine glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.