Aloe-emodin 8-O-beta-D-glucopyranoside
TL;DR: Aloe-emodin 8-O-beta-D-glucopyranoside (CAS 33037-46-6) is a chemical compound with molecular formula C21H20O10 and molecular weight 432.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-3-(hydroxymethyl)-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione
Also Known As: Aloe Emodin 8-Glucoside, Aloe-emodin-8-O-beta-D-glucopyranoside, aloe-emodin glucoside, Aloe emodin glucoside, Aloeemodin 8-glucoside
| Molecular Formula | C21H20O10 |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | -1.1614 |
| Topological Polar Surface Area | 173.98 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.10565 |
| Heavy Atoms | 31 |
| Complexity | 1046.6963 |
Chemical Identifiers
| CAS Number | 33037-46-6 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)CO |
Product Overview
Aloe-emodin 8-O-beta-D-glucopyranoside (CAS 33037-46-6), with molecular formula C21H20O10 and molecular weight 432.11 g/mol. IUPAC: 1-hydroxy-3-(hydroxymethyl)-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione.
Chemical Property Profile of Aloe-emodin 8-O-beta-D-glucopyranoside
Property Insights of Aloe-emodin 8-O-beta-D-glucopyranoside
The XLogP value of -1.1614 indicates that Aloe-emodin 8-O-beta-D-glucopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.98 Ų indicates high polarity, suggesting Aloe-emodin 8-O-beta-D-glucopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aloe-emodin 8-O-beta-D-glucopyranoside has 6 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 Aloe-emodin 8-O-beta-D-glucopyranoside?
The CAS number of Aloe-emodin 8-O-beta-D-glucopyranoside is 33037-46-6.
What is the molecular formula of Aloe-emodin 8-O-beta-D-glucopyranoside?
The molecular formula of Aloe-emodin 8-O-beta-D-glucopyranoside is C21H20O10.
What is the molecular weight of Aloe-emodin 8-O-beta-D-glucopyranoside?
The molecular weight of Aloe-emodin 8-O-beta-D-glucopyranoside is 432.11 g/mol.
Where can I buy Aloe-emodin 8-O-beta-D-glucopyranoside?
You can request a quote for Aloe-emodin 8-O-beta-D-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aloe-emodin 8-O-beta-D-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Aloe-emodin 8-O-beta-D-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.