Methyllycaconitine Perchlorate, Delphinium sp.
TL;DR: Methyllycaconitine Perchlorate, Delphinium sp. (CAS 1356-60-1) is a chemical compound with molecular formula C37H50N2O10 and molecular weight 682.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methyl 2-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzoate
Also Known As: Methyllycaconitine, Delsemidine, Delartine, Methyllycaconitine Perchlorate, Delphinium sp., BRD-A32164164-048-01-4
| Molecular Formula | C37H50N2O10 |
|---|---|
| Molecular Weight | 682.35 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 682.34656 |
| Heavy Atoms | 49 |
| Complexity | 1380.0 |
Chemical Identifiers
| CAS Number | 1356-60-1 |
|---|---|
| SMILES | CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N8C(=O)CC(C8=O)C |
| InChIKey | XLTANAWLDBYGFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyllycaconitine Perchlorate, Delphinium sp. (CAS 1356-60-1), with molecular formula C37H50N2O10 and molecular weight 682.35 g/mol. IUPAC: (11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methyl 2-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzoate.
Chemical Property Profile of Methyllycaconitine Perchlorate, Delphinium sp.
Property Insights of Methyllycaconitine Perchlorate, Delphinium sp.
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyllycaconitine Perchlorate, Delphinium sp.. The TPSA of 144.0 Ų indicates high polarity, suggesting Methyllycaconitine Perchlorate, Delphinium sp. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyllycaconitine Perchlorate, Delphinium sp. has 2 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 Methyllycaconitine Perchlorate, Delphinium sp.?
The CAS number of Methyllycaconitine Perchlorate, Delphinium sp. is 1356-60-1.
What is the molecular formula of Methyllycaconitine Perchlorate, Delphinium sp.?
The molecular formula of Methyllycaconitine Perchlorate, Delphinium sp. is C37H50N2O10.
What is the molecular weight of Methyllycaconitine Perchlorate, Delphinium sp.?
The molecular weight of Methyllycaconitine Perchlorate, Delphinium sp. is 682.35 g/mol.
Where can I buy Methyllycaconitine Perchlorate, Delphinium sp.?
You can request a quote for Methyllycaconitine Perchlorate, Delphinium sp. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyllycaconitine Perchlorate, Delphinium sp.?
Yes, KEHONG BIO provides custom synthesis services for Methyllycaconitine Perchlorate, Delphinium sp. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.