Glaucenine
TL;DR: Glaucenine (CAS 78018-27-6) is a chemical compound with molecular formula C31H47NO9 and molecular weight 577.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(21-acetyloxy-14-ethyl-2-hydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-4-yl) 2-methylbutanoate
Also Known As: Glaucenine, Aconitane-6,10,14-triol, 20-ethyl-1,16-dimethoxy-4-methyl-7,8-(methylenebis(oxy))-, 6-acetate 14-((2S)-2-methylbutanoate), (1alpha,6beta,14alpha,16beta)-
| Molecular Formula | C31H47NO9 |
|---|---|
| Molecular Weight | 577.33 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 577.3251 |
| Heavy Atoms | 41 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 78018-27-6 |
|---|---|
| SMILES | CCC(C)C(=O)OC1C2CC3(C1C4(CC2OC)C5(C(C6C37C5N(CC6(CCC7OC)C)CC)OC(=O)C)OCO4)O |
| InChIKey | LCGCCJQUIPIHIB-UHFFFAOYSA-N |
Product Overview
Glaucenine (CAS 78018-27-6), with molecular formula C31H47NO9 and molecular weight 577.33 g/mol. IUPAC: (21-acetyloxy-14-ethyl-2-hydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-4-yl) 2-methylbutanoate.
Chemical Property Profile of Glaucenine
Property Insights of Glaucenine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glaucenine. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glaucenine. Following Lipinski's Rule of Five, Glaucenine has 1 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 Glaucenine?
The CAS number of Glaucenine is 78018-27-6.
What is the molecular formula of Glaucenine?
The molecular formula of Glaucenine is C31H47NO9.
What is the molecular weight of Glaucenine?
The molecular weight of Glaucenine is 577.33 g/mol.
Where can I buy Glaucenine?
You can request a quote for Glaucenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glaucenine?
Yes, KEHONG BIO provides custom synthesis services for Glaucenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.