Phalloidinsulfone
TL;DR: Phalloidinsulfone (CAS 84313-39-3) is a chemical compound with molecular formula C35H48N8O13S and molecular weight 820.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
28-(2,3-dihydroxy-2-methylpropyl)-18-hydroxy-34-(1-hydroxyethyl)-23,31-dimethyl-12,12-dioxo-12λ6-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone
Also Known As: Phalloidinsulfone, cyclic(L-Alanyl-D-threonyl-L-cysteinyl-cis-4-hydroxy-L-prolyl-L-alanyl-2-sulfonyl-L-tryptophyl-4,5-dihydroxy-L-leucyl) cyclic (3-6)-sulfone, BRN 3028252
| Molecular Formula | C35H48N8O13S |
|---|---|
| Molecular Weight | 820.31 g/mol |
| LogP | -5.0641 |
| Topological Polar Surface Area | 325.76 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 820.30615 |
| Heavy Atoms | 57 |
| Complexity | 2053.359 |
Chemical Identifiers
| CAS Number | 84313-39-3 |
|---|---|
| SMILES | CC1C(=O)NC2CC3=C(NC4=CC=CC=C34)S(=O)(=O)CC(C(=O)N5CC(CC5C(=O)N1)O)NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC(C)(CO)O)C)C(C)O |
Product Overview
Phalloidinsulfone (CAS 84313-39-3), with molecular formula C35H48N8O13S and molecular weight 820.31 g/mol. IUPAC: 28-(2,3-dihydroxy-2-methylpropyl)-18-hydroxy-34-(1-hydroxyethyl)-23,31-dimethyl-12,12-dioxo-12λ6-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone.
Chemical Property Profile of Phalloidinsulfone
Property Insights of Phalloidinsulfone
The XLogP value of -5.0641 indicates that Phalloidinsulfone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 325.76 Ų indicates high polarity, suggesting Phalloidinsulfone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phalloidinsulfone has 11 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phalloidinsulfone?
The CAS number of Phalloidinsulfone is 84313-39-3.
What is the molecular formula of Phalloidinsulfone?
The molecular formula of Phalloidinsulfone is C35H48N8O13S.
What is the molecular weight of Phalloidinsulfone?
The molecular weight of Phalloidinsulfone is 820.31 g/mol.
Where can I buy Phalloidinsulfone?
You can request a quote for Phalloidinsulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phalloidinsulfone?
Yes, KEHONG BIO provides custom synthesis services for Phalloidinsulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.