宽叶千里光碱
TL;DR: 宽叶千里光碱 (CAS 480-81-9) is a chemical compound with molecular formula C18H23NO5 and molecular weight 333.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
宽叶千里光碱
(1R,7R,17R)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
Also Known As: Seneciphyllin, Seneciphynine, SENECIPHYLLINE, NCI60_002608
| Molecular Formula | C18H23NO5 |
|---|---|
| Molecular Weight | 333.16 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 333.15762 |
| Heavy Atoms | 24 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 480-81-9 |
|---|---|
| SMILES | CC=C1CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O |
| InChIKey | FCEVNJIUIMLVML-IIDMSEBBSA-N |
Product Overview
宽叶千里光碱 (CAS 480-81-9), with molecular formula C18H23NO5 and molecular weight 333.16 g/mol. IUPAC: (1R,7R,17R)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione.
Chemical Property Profile of 宽叶千里光碱
Property Insights of 宽叶千里光碱
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 宽叶千里光碱. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 宽叶千里光碱. Following Lipinski's Rule of Five, 宽叶千里光碱 has 1 hydrogen bond donor(s) and 6 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 宽叶千里光碱?
The CAS number of 宽叶千里光碱 is 480-81-9.
What is the molecular formula of 宽叶千里光碱?
The molecular formula of 宽叶千里光碱 is C18H23NO5.
What is the molecular weight of 宽叶千里光碱?
The molecular weight of 宽叶千里光碱 is 333.16 g/mol.
Where can I buy 宽叶千里光碱?
You can request a quote for 宽叶千里光碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 宽叶千里光碱?
Yes, KEHONG BIO provides custom synthesis services for 宽叶千里光碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.