8-Deoxyserratinine
TL;DR: 8-Deoxyserratinine (CAS 18331-31-2) is a chemical compound with molecular formula C16H25NO2 and molecular weight 263.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,6R,9S)-8-hydroxy-6-methyl-13-azatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one
Also Known As: 8-Deoxyserratinine, (4S,6R,9S)-8-hydroxy-6-methyl-13-azatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one, 4-Hydroxy-2-methyldecahydro-5H,9H,12H-indeno[7a,1-h]indolizin-12-one, (2R,4aS,13aS)-4-hydroxy-2-methyldecahydro-5H,9H,12H-indeno[7a,1-h]indolizin-12-one, RefChem:107057
| Molecular Formula | C16H25NO2 |
|---|---|
| Molecular Weight | 263.19 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.18854 |
| Heavy Atoms | 19 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 18331-31-2 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2CC(=O)C34[C@@]2(CCCN3CCC4)C(C1)O |
| InChIKey | CXCPHPDVYZHVON-PRAKJRAUSA-N |
Product Overview
8-Deoxyserratinine (CAS 18331-31-2), with molecular formula C16H25NO2 and molecular weight 263.19 g/mol. IUPAC: (4S,6R,9S)-8-hydroxy-6-methyl-13-azatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one.
Chemical Property Profile of 8-Deoxyserratinine
Property Insights of 8-Deoxyserratinine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Deoxyserratinine. With a topological polar surface area (TPSA) of 40.5 Ų, 8-Deoxyserratinine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Deoxyserratinine has 1 hydrogen bond donor(s) and 3 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 8-Deoxyserratinine?
The CAS number of 8-Deoxyserratinine is 18331-31-2.
What is the molecular formula of 8-Deoxyserratinine?
The molecular formula of 8-Deoxyserratinine is C16H25NO2.
What is the molecular weight of 8-Deoxyserratinine?
The molecular weight of 8-Deoxyserratinine is 263.19 g/mol.
Where can I buy 8-Deoxyserratinine?
You can request a quote for 8-Deoxyserratinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Deoxyserratinine?
Yes, KEHONG BIO provides custom synthesis services for 8-Deoxyserratinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.