17-脱溴海兔毒素
TL;DR: 17-脱溴海兔毒素 (CAS 52423-28-6) is a chemical compound with molecular formula C32H48O10 and molecular weight 592.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-脱溴海兔毒素
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
| Molecular Formula | C32H48O10 |
|---|---|
| Molecular Weight | 592.32 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.32477 |
| Heavy Atoms | 42 |
| Complexity | 956.0 |
Chemical Identifiers
| CAS Number | 52423-28-6 |
|---|---|
| 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 |
Product Overview
17-脱溴海兔毒素 (CAS 52423-28-6), with molecular formula C32H48O10 and molecular weight 592.32 g/mol. IUPAC: 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.
Chemical Property Profile of 17-脱溴海兔毒素
Property Insights of 17-脱溴海兔毒素
The XLogP value of 4.2 indicates that 17-脱溴海兔毒素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 17-脱溴海兔毒素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 17-脱溴海兔毒素 has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 17-脱溴海兔毒素?
The CAS number of 17-脱溴海兔毒素 is 52423-28-6.
What is the molecular formula of 17-脱溴海兔毒素?
The molecular formula of 17-脱溴海兔毒素 is C32H48O10.
What is the molecular weight of 17-脱溴海兔毒素?
The molecular weight of 17-脱溴海兔毒素 is 592.32 g/mol.
Where can I buy 17-脱溴海兔毒素?
You can request a quote for 17-脱溴海兔毒素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-脱溴海兔毒素?
Yes, KEHONG BIO provides custom synthesis services for 17-脱溴海兔毒素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.