N-Methylphalloidin
TL;DR: N-Methylphalloidin (CAS 3984-30-3) is a chemical compound with molecular formula C36H50N8O11S and molecular weight 802.33 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)-10,23,31-trimethyl-12-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: N-Methylphalloidin, N(sup ind)-Methylphalloidin, Phalloidin, 6-(2-mercapto-1-methyl-L-tryptophan)-, Phalloidin,6-(2-mercapto-1-methyl-L-tryptophan)-(9ci), Phalloidin,6-(2-mercapto-1-methyl-L-tryptophan)- (9CI)
| Molecular Formula | C36H50N8O11S |
|---|---|
| Molecular Weight | 802.33 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 306.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 802.332 |
| Heavy Atoms | 56 |
| Complexity | 1540.0 |
Chemical Identifiers
| CAS Number | 3984-30-3 |
|---|---|
| SMILES | CC1C(=O)NC2CC3=C(N(C4=CC=CC=C34)C)SCC(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 |
| InChIKey | XHUXYGHEHCWWIN-UHFFFAOYSA-N |
Product Overview
N-Methylphalloidin (CAS 3984-30-3), with molecular formula C36H50N8O11S and molecular weight 802.33 g/mol. IUPAC: 28-(2,3-dihydroxy-2-methylpropyl)-18-hydroxy-34-(1-hydroxyethyl)-10,23,31-trimethyl-12-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 N-Methylphalloidin
Property Insights of N-Methylphalloidin
The XLogP value of -1.7 indicates that N-Methylphalloidin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 306.0 Ų indicates high polarity, suggesting N-Methylphalloidin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Methylphalloidin has 10 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Methylphalloidin?
The CAS number of N-Methylphalloidin is 3984-30-3.
What is the molecular formula of N-Methylphalloidin?
The molecular formula of N-Methylphalloidin is C36H50N8O11S.
What is the molecular weight of N-Methylphalloidin?
The molecular weight of N-Methylphalloidin is 802.33 g/mol.
Where can I buy N-Methylphalloidin?
You can request a quote for N-Methylphalloidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylphalloidin?
Yes, KEHONG BIO provides custom synthesis services for N-Methylphalloidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.