Stephasubine
TL;DR: Stephasubine (CAS 1138-47-2) is a chemical compound with molecular formula C36H34N2O6 and molecular weight 590.2417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R)-6,20,25-trimethoxy-30-methyl-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-3(36),4,6,9(35),10,12(34),14,16,18,20,22(33),24,26,31-tetradecaen-21-ol
Also Known As: Stephasubine, (+)-Stephasubine, J2.397.650A, 6,6',12'-trimethoxy-2'-methyl-1,2,3,4-tetradehydrooxyacanthan-7-ol, (1R)-6,20,25-trimethoxy-30-methyl-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-3,5,7(36),9,11,14,16,18,20,22(33),24,26,31,34-tetradecaen-21-ol
Technical Specifications
| Molecular Formula | C36H34N2O6 |
| Molecular Weight | 590.2417 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 590.2417 Da |
| Heavy Atoms | 44 |
| Complexity | 932.0 |
| SMILES | CN1CCC2=CC(=C3C=C2[C@H]1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6=NC=CC7=CC(=C(C(=C67)O3)O)OC)C=C5)OC |
| InChIKey | NEYGQYOOZBPYMQ-MUUNZHRXSA-N |
Chemical Property Profile of Stephasubine
Property Insights of Stephasubine
The XLogP value of 6.6 indicates that Stephasubine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Stephasubine. Following Lipinski's Rule of Five, Stephasubine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Stephasubine?
The CAS number of Stephasubine is 1138-47-2.
What is the molecular formula of Stephasubine?
The molecular formula of Stephasubine is C36H34N2O6.
What is the molecular weight of Stephasubine?
The molecular weight of Stephasubine is 590.2417 g/mol.
Where can I buy Stephasubine?
You can request a quote for Stephasubine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Stephasubine?
Yes, CoreyChem provides custom synthesis services for Stephasubine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.