Indoxyl beta-D-glucuronide cha salt, ibdg
TL;DR: Indoxyl beta-D-glucuronide cha salt, ibdg (CAS 35804-66-1) is a chemical compound with molecular formula C20H28N2O7 and molecular weight 408.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexanamine;(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)oxane-2-carboxylic acid
Also Known As: Indoxyl glucuronide, Indoxyl-beta-D-glucuronide, Y-beta-D-glucuronide CHX salt, Indoxyl beta-D-glucuronide cha salt, ibdg, Indoxyl b-D-glucuronide CHX salt
| Molecular Formula | C20H28N2O7 |
|---|---|
| Molecular Weight | 408.19 g/mol |
| LogP | 0.7167 |
| Topological Polar Surface Area | 158.26 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.18964 |
| Heavy Atoms | 29 |
| Complexity | 804.9786 |
Chemical Identifiers
| CAS Number | 35804-66-1 |
|---|---|
| SMILES | C1CCC(CC1)N.C1=CC=C2C(=C1)C(=CN2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
Product Overview
Indoxyl beta-D-glucuronide cha salt, ibdg (CAS 35804-66-1), with molecular formula C20H28N2O7 and molecular weight 408.19 g/mol. IUPAC: cyclohexanamine;(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(1H-indol-3-yloxy)oxane-2-carboxylic acid.
Chemical Property Profile of Indoxyl beta-D-glucuronide cha salt, ibdg
Property Insights of Indoxyl beta-D-glucuronide cha salt, ibdg
The XLogP value of 0.7167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indoxyl beta-D-glucuronide cha salt, ibdg. The TPSA of 158.26 Ų indicates high polarity, suggesting Indoxyl beta-D-glucuronide cha salt, ibdg may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Indoxyl beta-D-glucuronide cha salt, ibdg has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Indoxyl beta-D-glucuronide cha salt, ibdg?
The CAS number of Indoxyl beta-D-glucuronide cha salt, ibdg is 35804-66-1.
What is the molecular formula of Indoxyl beta-D-glucuronide cha salt, ibdg?
The molecular formula of Indoxyl beta-D-glucuronide cha salt, ibdg is C20H28N2O7.
What is the molecular weight of Indoxyl beta-D-glucuronide cha salt, ibdg?
The molecular weight of Indoxyl beta-D-glucuronide cha salt, ibdg is 408.19 g/mol.
Where can I buy Indoxyl beta-D-glucuronide cha salt, ibdg?
You can request a quote for Indoxyl beta-D-glucuronide cha salt, ibdg directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indoxyl beta-D-glucuronide cha salt, ibdg?
Yes, KEHONG BIO provides custom synthesis services for Indoxyl beta-D-glucuronide cha salt, ibdg and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.