Aplysiatoxin, 17-debromo-
TL;DR: Aplysiatoxin, 17-debromo- (CAS 52423-28-6) is a chemical compound with molecular formula C32H48O10 and molecular weight 592.32477 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-hydroxy-9-(1-hydroxyethyl)-3-[5-(3-hydroxyphenyl)-5-methoxypentan-2-yl]-4,14,16,16-tetramethyl-2,6,10,17-tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione
Also Known As: Debromoaplysiatoxin, Aplysiatoxin, 17-debromo-, Debromoaplysia toxin, Bromopride hydrochloride, G-2408
Technical Specifications
| Molecular Formula | C32H48O10 |
| Molecular Weight | 592.32477 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.32477 Da |
| Heavy Atoms | 42 |
| Complexity | 956.0 |
| SMILES | CC1CC(C23CC(C(C(O2)C(C)CCC(C4=CC(=CC=C4)O)OC)C)OC(=O)CC(OC(=O)CC1(O3)O)C(C)O)(C)C |
| InChIKey | REAZZDPREXHWNV-UHFFFAOYSA-N |
Chemical Property Profile of Aplysiatoxin, 17-debromo-
Property Insights of Aplysiatoxin, 17-debromo-
The XLogP value of 4.2 indicates that Aplysiatoxin, 17-debromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting Aplysiatoxin, 17-debromo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aplysiatoxin, 17-debromo- has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Aplysiatoxin, 17-debromo-?
The CAS number of Aplysiatoxin, 17-debromo- is 52423-28-6.
What is the molecular formula of Aplysiatoxin, 17-debromo-?
The molecular formula of Aplysiatoxin, 17-debromo- is C32H48O10.
What is the molecular weight of Aplysiatoxin, 17-debromo-?
The molecular weight of Aplysiatoxin, 17-debromo- is 592.32477 g/mol.
Where can I buy Aplysiatoxin, 17-debromo-?
You can request a quote for Aplysiatoxin, 17-debromo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aplysiatoxin, 17-debromo-?
Yes, CoreyChem provides custom synthesis services for Aplysiatoxin, 17-debromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.