7-Hydroxyaloin B
TL;DR: 7-Hydroxyaloin B (CAS 82461-12-9) is a chemical compound with molecular formula C21H22O10 and molecular weight 434.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10R)-1,2,8-trihydroxy-6-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
Also Known As: 7-Hydroxyaloin, 7-Hydroxyaloin B, J2.890.718D, 9(10H)-Anthracenone, 10-beta-D-glucopyranosyl-1,2,8-trihydroxy-6-(hydroxymethyl)-, (10R)-, (10R)-1,2,8-trihydroxy-6-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
| Molecular Formula | C21H22O10 |
|---|---|
| Molecular Weight | 434.12 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.1213 |
| Heavy Atoms | 31 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 82461-12-9 |
|---|---|
| SMILES | C1=CC(=C(C2=C1[C@H](C3=C(C2=O)C(=CC(=C3)CO)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O |
| InChIKey | HKKOALUTOMGGMT-UUBBYFPSSA-N |
Product Overview
7-Hydroxyaloin B (CAS 82461-12-9), with molecular formula C21H22O10 and molecular weight 434.12 g/mol. IUPAC: (10R)-1,2,8-trihydroxy-6-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one.
Chemical Property Profile of 7-Hydroxyaloin B
Property Insights of 7-Hydroxyaloin B
The XLogP value of -0.5 indicates that 7-Hydroxyaloin B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting 7-Hydroxyaloin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Hydroxyaloin B has 8 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 7-Hydroxyaloin B?
The CAS number of 7-Hydroxyaloin B is 82461-12-9.
What is the molecular formula of 7-Hydroxyaloin B?
The molecular formula of 7-Hydroxyaloin B is C21H22O10.
What is the molecular weight of 7-Hydroxyaloin B?
The molecular weight of 7-Hydroxyaloin B is 434.12 g/mol.
Where can I buy 7-Hydroxyaloin B?
You can request a quote for 7-Hydroxyaloin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Hydroxyaloin B?
Yes, KEHONG BIO provides custom synthesis services for 7-Hydroxyaloin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.