Taxcultine
TL;DR: Taxcultine (CAS 153415-46-4) is a chemical compound with molecular formula C44H53NO14 and molecular weight 819.3466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-15-[(2R,3S)-3-(butanoylamino)-2-hydroxy-3-phenylpropanoyl]oxy-1,9-dihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Also Known As: Taxcultine, Taxol D, TAXCULTIN, Paclitaxel Impurity 28, Paclitaxel Impurity 36
Technical Specifications
| Molecular Formula | C44H53NO14 |
| Molecular Weight | 819.3466 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 15 |
| Exact Mass | 819.3466 Da |
| Heavy Atoms | 59 |
| Complexity | 1700.0 |
| SMILES | CCCC(=O)N[C@@H](C1=CC=CC=C1)[C@H](C(=O)O[C@H]2C[C@]3([C@H]([C@H]4[C@@]([C@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)(C(=O)[C@@H](C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O |
| InChIKey | SXPIMOCRRJUHJY-MNLIZOKASA-N |
Chemical Property Profile of Taxcultine
Property Insights of Taxcultine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Taxcultine. The TPSA of 221.0 Ų indicates high polarity, suggesting Taxcultine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Taxcultine has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Taxcultine?
The CAS number of Taxcultine is 153415-46-4.
What is the molecular formula of Taxcultine?
The molecular formula of Taxcultine is C44H53NO14.
What is the molecular weight of Taxcultine?
The molecular weight of Taxcultine is 819.3466 g/mol.
Where can I buy Taxcultine?
You can request a quote for Taxcultine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Taxcultine?
Yes, CoreyChem provides custom synthesis services for Taxcultine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.