Daphnandrine
TL;DR: Daphnandrine (CAS 1183-76-2) is a chemical compound with molecular formula C36H38N2O6 and molecular weight 594.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,14S)-6,20,25-trimethoxy-15-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),18,20,22(33),24,26,31-dodecaen-21-ol
Also Known As: Daphnandrine, Norlimacusine, (+)-Daphandrine, (+)-daphnandrine, DAPHNANDRINE [MI]
| Molecular Formula | C36H38N2O6 |
|---|---|
| Molecular Weight | 594.27 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 594.273 |
| Heavy Atoms | 44 |
| Complexity | 932.0 |
Chemical Identifiers
| CAS Number | 1183-76-2 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@@H]6C7=CC(=C(C=C7CCN6)OC)O3)OC)O)OC |
| InChIKey | REKCBEFSIKOPTD-IZLXSDGUSA-N |
Product Overview
Daphnandrine (CAS 1183-76-2), with molecular formula C36H38N2O6 and molecular weight 594.27 g/mol. IUPAC: (1R,14S)-6,20,25-trimethoxy-15-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),18,20,22(33),24,26,31-dodecaen-21-ol.
Chemical Property Profile of Daphnandrine
Property Insights of Daphnandrine
The XLogP value of 5.9 indicates that Daphnandrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Daphnandrine. Following Lipinski's Rule of Five, Daphnandrine has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Daphnandrine?
The CAS number of Daphnandrine is 1183-76-2.
What is the molecular formula of Daphnandrine?
The molecular formula of Daphnandrine is C36H38N2O6.
What is the molecular weight of Daphnandrine?
The molecular weight of Daphnandrine is 594.27 g/mol.
Where can I buy Daphnandrine?
You can request a quote for Daphnandrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daphnandrine?
Yes, KEHONG BIO provides custom synthesis services for Daphnandrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.