Ferrienterochelin
TL;DR: Ferrienterochelin (CAS 62280-34-6) is a chemical compound with molecular formula C30H24FeN3O15 and molecular weight 722.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[7,11-bis[(2,3-dioxidobenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]carbamoyl]benzene-1,2-diolate;hydron;iron(3+)
Also Known As: Ferrienterochelin, Ferric enterochelin, 3-[[7,11-bis[(2,3-dioxidobenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]carbamoyl]benzene-1,2-diolate;hydron;iron(3+), Ferrate(3-), ((N,N',N''-(2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl)tris(2,3-dihydroxybenzamidato))(6-)-O2,O2',O2'',O3,O3',O3'')-, trihydrogen, stereoisomer, 3-[[7,11-bis[(2,3-dioxidobenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]carbamoyl]benzene-1,2-diolate,hydron,iron(3+)
| Molecular Formula | C30H24FeN3O15 |
|---|---|
| Molecular Weight | 722.06 g/mol |
| LogP | -4.198 |
| Topological Polar Surface Area | 304.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 722.05566 |
| Heavy Atoms | 49 |
| Complexity | 1596.4292 |
Chemical Identifiers
| CAS Number | 62280-34-6 |
|---|---|
| SMILES | [H+].[H+].[H+].C1C(C(=O)OCC(C(=O)OCC(C(=O)O1)NC(=O)C2=C(C(=CC=C2)[O-])[O-])NC(=O)C3=C(C(=CC=C3)[O-])[O-])NC(=O)C4=C(C(=CC=C4)[O-])[O-].[Fe+3] |
Product Overview
Ferrienterochelin (CAS 62280-34-6), with molecular formula C30H24FeN3O15 and molecular weight 722.06 g/mol. IUPAC: 3-[[7,11-bis[(2,3-dioxidobenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododec-3-yl]carbamoyl]benzene-1,2-diolate;hydron;iron(3+).
Chemical Property Profile of Ferrienterochelin
Property Insights of Ferrienterochelin
The XLogP value of -4.198 indicates that Ferrienterochelin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 304.56 Ų indicates high polarity, suggesting Ferrienterochelin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ferrienterochelin has 3 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ferrienterochelin?
The CAS number of Ferrienterochelin is 62280-34-6.
What is the molecular formula of Ferrienterochelin?
The molecular formula of Ferrienterochelin is C30H24FeN3O15.
What is the molecular weight of Ferrienterochelin?
The molecular weight of Ferrienterochelin is 722.06 g/mol.
Where can I buy Ferrienterochelin?
You can request a quote for Ferrienterochelin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferrienterochelin?
Yes, KEHONG BIO provides custom synthesis services for Ferrienterochelin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.