Phytochelatin 3
TL;DR: Phytochelatin 3 (CAS 86220-45-3) is a chemical compound with molecular formula C26H41N7O14S3 and molecular weight 771.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: phytochelatin 3, Cadystin A, Cadystin, Cadystin Protein, S Pombe, Cadystin A (reduced)
| Molecular Formula | C26H41N7O14S3 |
|---|---|
| Molecular Weight | 771.19 g/mol |
| LogP | -6.7 |
| Topological Polar Surface Area | 353.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 25 |
| Exact Mass | 771.1874 |
| Heavy Atoms | 50 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 86220-45-3 |
|---|---|
| SMILES | C(CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O)C(=O)O)[C@@H](C(=O)O)N |
| InChIKey | PCOMFCPXXQONPD-QNILMXGZSA-N |
Product Overview
Phytochelatin 3 (CAS 86220-45-3), with molecular formula C26H41N7O14S3 and molecular weight 771.19 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-[[(1S)-1-carboxy-4-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-oxobutyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of Phytochelatin 3
Property Insights of Phytochelatin 3
The XLogP value of -6.7 indicates that Phytochelatin 3 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 353.0 Ų indicates high polarity, suggesting Phytochelatin 3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phytochelatin 3 has 14 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phytochelatin 3?
The CAS number of Phytochelatin 3 is 86220-45-3.
What is the molecular formula of Phytochelatin 3?
The molecular formula of Phytochelatin 3 is C26H41N7O14S3.
What is the molecular weight of Phytochelatin 3?
The molecular weight of Phytochelatin 3 is 771.19 g/mol.
Where can I buy Phytochelatin 3?
You can request a quote for Phytochelatin 3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phytochelatin 3?
Yes, KEHONG BIO provides custom synthesis services for Phytochelatin 3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.