Phaseolotoxin
TL;DR: Phaseolotoxin (CAS 59299-63-7) is a chemical compound with molecular formula C15H34N9O8PS and molecular weight 531.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[(2R)-2-[[(2R)-2-amino-5-[[amino-(sulfoamino)phosphoryl]amino]pentanoyl]amino]propanoyl]amino]-6-(diaminomethylideneamino)hexanoic acid
Also Known As: Phaseolotoxin, Phaseolotoxin A, Phaseotoxin, Ndelta-(N'-sulphodiaminophosphinyl)-ornithyl-alanyl-homoarginine, (2R)-2-[[(2R)-2-[[(2R)-2-amino-5-[[amino-(sulfoamino)phosphoryl]amino]pentanoyl]amino]propanoyl]amino]-6-(diaminomethylideneamino)hexanoic acid
| Molecular Formula | C15H34N9O8PS |
|---|---|
| Molecular Weight | 531.20 g/mol |
| LogP | -3.3395 |
| Topological Polar Surface Area | 307.44 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 531.19885 |
| Heavy Atoms | 34 |
| Complexity | 881.10516 |
Chemical Identifiers
| CAS Number | 59299-63-7 |
|---|---|
| SMILES | C[C@H](C(=O)N[C@H](CCCCN=C(N)N)C(=O)O)NC(=O)[C@@H](CCCNP(=O)(N)NS(=O)(=O)O)N |
Product Overview
Phaseolotoxin (CAS 59299-63-7), with molecular formula C15H34N9O8PS and molecular weight 531.20 g/mol. IUPAC: (2R)-2-[[(2R)-2-[[(2R)-2-amino-5-[[amino-(sulfoamino)phosphoryl]amino]pentanoyl]amino]propanoyl]amino]-6-(diaminomethylideneamino)hexanoic acid.
Chemical Property Profile of Phaseolotoxin
Property Insights of Phaseolotoxin
The XLogP value of -3.3395 indicates that Phaseolotoxin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 307.44 Ų indicates high polarity, suggesting Phaseolotoxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phaseolotoxin has 10 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phaseolotoxin?
The CAS number of Phaseolotoxin is 59299-63-7.
What is the molecular formula of Phaseolotoxin?
The molecular formula of Phaseolotoxin is C15H34N9O8PS.
What is the molecular weight of Phaseolotoxin?
The molecular weight of Phaseolotoxin is 531.20 g/mol.
Where can I buy Phaseolotoxin?
You can request a quote for Phaseolotoxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phaseolotoxin?
Yes, KEHONG BIO provides custom synthesis services for Phaseolotoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.