Anhydrodebromoaplysiatoxin
TL;DR: Anhydrodebromoaplysiatoxin (CAS 63543-22-6) is a chemical compound with molecular formula C32H46O9 and molecular weight 574.3142 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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]octadec-13-ene-7,11-dione
Also Known As: Anhydrodebromoaplysiatoxin, Debromoaplysiatoxin, Aplysiatoxin, 17-debromo-3,4-didehydro-3-deoxy-, 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]octadec-13-ene-7,11-dione(non-preferred name), 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)octadec-13-ene-7,11-dione
Technical Specifications
| Molecular Formula | C32H46O9 |
| Molecular Weight | 574.3142 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 574.3142 Da |
| Heavy Atoms | 41 |
| Complexity | 976.0 |
| SMILES | CC1C2CC3(C(CC(=C(O3)CC(=O)OC(CC(=O)O2)C(C)O)C)(C)C)OC1C(C)CCC(C4=CC(=CC=C4)O)OC |
| InChIKey | HCEQACRMJXGKHI-UHFFFAOYSA-N |
Chemical Property Profile of Anhydrodebromoaplysiatoxin
Property Insights of Anhydrodebromoaplysiatoxin
The XLogP value of 4.5 indicates that Anhydrodebromoaplysiatoxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Anhydrodebromoaplysiatoxin. Following Lipinski's Rule of Five, Anhydrodebromoaplysiatoxin has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Anhydrodebromoaplysiatoxin?
The CAS number of Anhydrodebromoaplysiatoxin is 63543-22-6.
What is the molecular formula of Anhydrodebromoaplysiatoxin?
The molecular formula of Anhydrodebromoaplysiatoxin is C32H46O9.
What is the molecular weight of Anhydrodebromoaplysiatoxin?
The molecular weight of Anhydrodebromoaplysiatoxin is 574.3142 g/mol.
Where can I buy Anhydrodebromoaplysiatoxin?
You can request a quote for Anhydrodebromoaplysiatoxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Anhydrodebromoaplysiatoxin?
Yes, CoreyChem provides custom synthesis services for Anhydrodebromoaplysiatoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.