(-)-Thalmiculimine
TL;DR: (-)-Thalmiculimine (CAS 115334-00-4) is a chemical compound with molecular formula C37H38N2O7 and molecular weight 622.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(25S)-4,5,20,31-tetramethoxy-26-methyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,11,14(36),15,17(35),19,21,23(34),29,32-tridecaen-30-ol
Also Known As: Thalmiculimine, (-)-Thalmiculimine, KST-1A0719, (25s)-4,5,20,31-tetramethoxy-26-methyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3,5,7,11,14,16,19(34),20,22,29,32,35-tridecaen-30-ol(non-preferred name), 1H-8,9,13-(1,3)Butadien(1)yl(4)ylidene-4,6:15,18-dietheno-20,24-metheno-10H-pyrido(2,3-t)(1,13,6)dioxaazacyclotricosin-34-ol, 2,3,11,14,25,25a-hexahydro-21,31,32,33-tetramethoxy-1-methyl-, (S)-
| Molecular Formula | C37H38N2O7 |
|---|---|
| Molecular Weight | 622.27 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 622.2679 |
| Heavy Atoms | 46 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 115334-00-4 |
|---|---|
| SMILES | CN1CCC2=C(C(=C3C=C2[C@@H]1CC4=CC(=C(C=C4)OC)OC5=CC=C(CC6=NCCC7=C(O3)C(=C(C=C76)OC)OC)C=C5)OC)O |
| InChIKey | GLADJWPVQRCRIG-LJAQVGFWSA-N |
Product Overview
(-)-Thalmiculimine (CAS 115334-00-4), with molecular formula C37H38N2O7 and molecular weight 622.27 g/mol. IUPAC: (25S)-4,5,20,31-tetramethoxy-26-methyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,11,14(36),15,17(35),19,21,23(34),29,32-tridecaen-30-ol.
Chemical Property Profile of (-)-Thalmiculimine
Property Insights of (-)-Thalmiculimine
The XLogP value of 5.8 indicates that (-)-Thalmiculimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-Thalmiculimine. Following Lipinski's Rule of Five, (-)-Thalmiculimine has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-Thalmiculimine?
The CAS number of (-)-Thalmiculimine is 115334-00-4.
What is the molecular formula of (-)-Thalmiculimine?
The molecular formula of (-)-Thalmiculimine is C37H38N2O7.
What is the molecular weight of (-)-Thalmiculimine?
The molecular weight of (-)-Thalmiculimine is 622.27 g/mol.
Where can I buy (-)-Thalmiculimine?
You can request a quote for (-)-Thalmiculimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-Thalmiculimine?
Yes, KEHONG BIO provides custom synthesis services for (-)-Thalmiculimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.