Axillarine
TL;DR: Axillarine (CAS 19637-66-2) is a chemical compound with molecular formula C18H27NO7 and molecular weight 369.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4R,5R,6R,16R)-5,6-dihydroxy-6-[(1R)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione
Also Known As: Axillarine, KST-1A2520, (3r,4r,5r,13ar,13br)-4,5-dihydroxy-5-[(1r)-1-hydroxyethyl]-3-(propan-2-yl)-4,5,8,10,12,13,13a,13b-octahydro-2h-[1,6]dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3h)-dione, (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-((1R)-1-hydroxyethyl)-4-propan-2-yl-2,8-dioxa-13-azatricyclo(8.5.1.013,16)hexadec-10-ene-3,7-dione, (1R,4R,5R,6R,16R)-5,6-Dihydroxy-6-[(1R)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione
| Molecular Formula | C18H27NO7 |
|---|---|
| Molecular Weight | 369.18 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.17874 |
| Heavy Atoms | 26 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 19637-66-2 |
|---|---|
| SMILES | C[C@H]([C@]1([C@@H]([C@H](C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC1=O)C(C)C)O)O)O |
| InChIKey | JGQRXNDIMGIXDT-TZWYKRATSA-N |
Product Overview
Axillarine (CAS 19637-66-2), with molecular formula C18H27NO7 and molecular weight 369.18 g/mol. IUPAC: (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-[(1R)-1-hydroxyethyl]-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione.
Chemical Property Profile of Axillarine
Property Insights of Axillarine
The XLogP value of -0.2 indicates that Axillarine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Axillarine. Following Lipinski's Rule of Five, Axillarine has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Axillarine?
The CAS number of Axillarine is 19637-66-2.
What is the molecular formula of Axillarine?
The molecular formula of Axillarine is C18H27NO7.
What is the molecular weight of Axillarine?
The molecular weight of Axillarine is 369.18 g/mol.
Where can I buy Axillarine?
You can request a quote for Axillarine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Axillarine?
Yes, KEHONG BIO provides custom synthesis services for Axillarine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.