Amoenin A3
TL;DR: Amoenin A3 (CAS 206563-47-5) is a chemical compound with molecular formula C21H20O11 and molecular weight 448.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Trifolin, Amoenin A3, kaempferol-3-O-beta-D-mannoside, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-(beta-D-mannopyranosyloxy)-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
| Molecular Formula | C21H20O11 |
|---|---|
| Molecular Weight | 448.10 g/mol |
| LogP | -0.2445 |
| Topological Polar Surface Area | 190.28 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.10056 |
| Heavy Atoms | 32 |
| Complexity | 1185.0555 |
Chemical Identifiers
| CAS Number | 206563-47-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O |
Product Overview
Amoenin A3 (CAS 206563-47-5), with molecular formula C21H20O11 and molecular weight 448.10 g/mol. IUPAC: 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Amoenin A3
Property Insights of Amoenin A3
The XLogP value of -0.2445 indicates that Amoenin A3 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.28 Ų indicates high polarity, suggesting Amoenin A3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amoenin A3 has 7 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 Amoenin A3?
The CAS number of Amoenin A3 is 206563-47-5.
What is the molecular formula of Amoenin A3?
The molecular formula of Amoenin A3 is C21H20O11.
What is the molecular weight of Amoenin A3?
The molecular weight of Amoenin A3 is 448.10 g/mol.
Where can I buy Amoenin A3?
You can request a quote for Amoenin A3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amoenin A3?
Yes, KEHONG BIO provides custom synthesis services for Amoenin A3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.