Aspidoalbine
TL;DR: Aspidoalbine (CAS 2122-25-0) is a chemical compound with molecular formula C24H32N2O5 and molecular weight 428.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1R,4R,12R,16S)-7-hydroxy-8,9-dimethoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6,8,10-trien-5-yl]propan-1-one
Also Known As: Aspidoalbine, (+)-Aspidoalbine, 1-[(1R,4R,12R,16S)-7-hydroxy-8,9-dimethoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6,8,10-trien-5-yl]propan-1-one, 19,21-Epoxy-15,16-dimethoxy-1-(1-oxopropyl)aspidospermidin-17-ol, 1-(17-Hydroxy-15,16-dimethoxy-19,21-epoxyaspidospermidin-1-yl)propan-1-one
| Molecular Formula | C24H32N2O5 |
|---|---|
| Molecular Weight | 428.23 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.2311 |
| Heavy Atoms | 31 |
| Complexity | 764.0 |
Chemical Identifiers
| CAS Number | 2122-25-0 |
|---|---|
| SMILES | CCC(=O)N1[C@@H]2CC[C@@]34CCCN5[C@]3([C@]2(CC5)C6=CC(=C(C(=C61)O)OC)OC)OCC4 |
| InChIKey | BJYVZJQGRUSSBS-BMZZKGLRSA-N |
Product Overview
Aspidoalbine (CAS 2122-25-0), with molecular formula C24H32N2O5 and molecular weight 428.23 g/mol. IUPAC: 1-[(1R,4R,12R,16S)-7-hydroxy-8,9-dimethoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6,8,10-trien-5-yl]propan-1-one.
Chemical Property Profile of Aspidoalbine
Property Insights of Aspidoalbine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aspidoalbine. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Aspidoalbine. Following Lipinski's Rule of Five, Aspidoalbine 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 Aspidoalbine?
The CAS number of Aspidoalbine is 2122-25-0.
What is the molecular formula of Aspidoalbine?
The molecular formula of Aspidoalbine is C24H32N2O5.
What is the molecular weight of Aspidoalbine?
The molecular weight of Aspidoalbine is 428.23 g/mol.
Where can I buy Aspidoalbine?
You can request a quote for Aspidoalbine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aspidoalbine?
Yes, KEHONG BIO provides custom synthesis services for Aspidoalbine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.