Oxymaistemonine
TL;DR: Oxymaistemonine (CAS 137031-45-9) is a chemical compound with molecular formula C23H29NO7 and molecular weight 431.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,13S)-9-hydroxy-4'-methoxy-3',11-dimethyl-4-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]spiro[5-azatricyclo[8.3.0.01,5]tridec-10-ene-13,5'-furan]-2',12-dione
Also Known As: Oxymaistemonine, (2'S,3S)-8-Hydroxy-3'-methoxy-4',9-dimethyl-3-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-2,3,5,6,7,8-hexahydro-1H,5'H,10H-spiro[cyclopenta[b]pyrrolo[1,2-a]azepine-11,2'-furan]-5',10-dione, 8-Hydroxy-3'-methoxy-4',9-dimethyl-3-(4-methyl-5-oxooxolan-2-yl)-2,3,5,6,7,8-hexahydro-1H,5'H,10H-spiro[cyclopenta[b]pyrrolo[1,2-a]azepine-11,2'-furan]-5',10-dione
| Molecular Formula | C23H29NO7 |
|---|---|
| Molecular Weight | 431.19 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 431.1944 |
| Heavy Atoms | 31 |
| Complexity | 952.0 |
Chemical Identifiers
| CAS Number | 137031-45-9 |
|---|---|
| SMILES | C[C@H]1C[C@H](OC1=O)[C@@H]2CCC34N2CCCC(C3=C(C(=O)[C@@]45C(=C(C(=O)O5)C)OC)C)O |
| InChIKey | ZNAQDRGQMUIKMM-FCEQWVTPSA-N |
Product Overview
Oxymaistemonine (CAS 137031-45-9), with molecular formula C23H29NO7 and molecular weight 431.19 g/mol. IUPAC: (4S,13S)-9-hydroxy-4'-methoxy-3',11-dimethyl-4-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]spiro[5-azatricyclo[8.3.0.01,5]tridec-10-ene-13,5'-furan]-2',12-dione.
Chemical Property Profile of Oxymaistemonine
Property Insights of Oxymaistemonine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxymaistemonine. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxymaistemonine. Following Lipinski's Rule of Five, Oxymaistemonine has 1 hydrogen bond donor(s) and 8 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 Oxymaistemonine?
The CAS number of Oxymaistemonine is 137031-45-9.
What is the molecular formula of Oxymaistemonine?
The molecular formula of Oxymaistemonine is C23H29NO7.
What is the molecular weight of Oxymaistemonine?
The molecular weight of Oxymaistemonine is 431.19 g/mol.
Where can I buy Oxymaistemonine?
You can request a quote for Oxymaistemonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxymaistemonine?
Yes, KEHONG BIO provides custom synthesis services for Oxymaistemonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.