Taxuyunnanine
TL;DR: Taxuyunnanine (CAS 153415-45-3) is a chemical compound with molecular formula C46H57NO14 and molecular weight 847.3779 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,2S,3R,4S,7R,9R,10S,12R,15S)-4,12-diacetyloxy-15-[(2R)-3-(hexanoylamino)-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: Taxuyunnanine, Taxol C, Paclitaxel C
Technical Specifications
| Molecular Formula | C46H57NO14 |
| Molecular Weight | 847.3779 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 17 |
| Exact Mass | 847.3779 Da |
| Heavy Atoms | 61 |
| Complexity | 1730.0 |
| SMILES | CCCCCC(=O)NC(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 | BEHTXUBGUDGCNQ-YOGGUJKVSA-N |
Chemical Property Profile of Taxuyunnanine
Property Insights of Taxuyunnanine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Taxuyunnanine. The TPSA of 221.0 Ų indicates high polarity, suggesting Taxuyunnanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Taxuyunnanine 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 Taxuyunnanine?
The CAS number of Taxuyunnanine is 153415-45-3.
What is the molecular formula of Taxuyunnanine?
The molecular formula of Taxuyunnanine is C46H57NO14.
What is the molecular weight of Taxuyunnanine?
The molecular weight of Taxuyunnanine is 847.3779 g/mol.
Where can I buy Taxuyunnanine?
You can request a quote for Taxuyunnanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Taxuyunnanine?
Yes, CoreyChem provides custom synthesis services for Taxuyunnanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.