Ambocin
TL;DR: Ambocin (CAS 108044-05-9) is a chemical compound with molecular formula C26H28O14 and molecular weight 564.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-3-(4-hydroxyphenyl)chromen-4-one
Also Known As: Ambocin, (-)-Ambocin, 6''-O-apiosylgenistin, Genistein 7-O-apiosyl-(1->6)-glucoside, HY-N8980
| Molecular Formula | C26H28O14 |
|---|---|
| Molecular Weight | 564.15 g/mol |
| LogP | -1.4852 |
| Topological Polar Surface Area | 228.97 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 564.1479 |
| Heavy Atoms | 40 |
| Complexity | 1407.0167 |
Chemical Identifiers
| CAS Number | 108044-05-9 |
|---|---|
| SMILES | C1[C@@]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C4C(=C3)OC=C(C4=O)C5=CC=C(C=C5)O)O)O)O)O)O)(CO)O |
Product Overview
Ambocin (CAS 108044-05-9), with molecular formula C26H28O14 and molecular weight 564.15 g/mol. IUPAC: 7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-3-(4-hydroxyphenyl)chromen-4-one.
Chemical Property Profile of Ambocin
Property Insights of Ambocin
The XLogP value of -1.4852 indicates that Ambocin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 228.97 Ų indicates high polarity, suggesting Ambocin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ambocin has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ambocin?
The CAS number of Ambocin is 108044-05-9.
What is the molecular formula of Ambocin?
The molecular formula of Ambocin is C26H28O14.
What is the molecular weight of Ambocin?
The molecular weight of Ambocin is 564.15 g/mol.
Where can I buy Ambocin?
You can request a quote for Ambocin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ambocin?
Yes, KEHONG BIO provides custom synthesis services for Ambocin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.