CHEBI:64492 - ferricrocin

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ChEBI Name ferricrocin
ChEBI ID CHEBI:64492
Definition A member of the class of ferrichromes that is an iron(III) chelate of the homodetic cyclic hexapeptide cyclo(glycyl-L-serylglycyl-N5-acetyl-N5-hydroxy-L-ornithyl-N5-acetyl-N5-hydroxy-L-ornithyl-N5-acetyl-N5-hydroxy-L-ornithyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H44FeN9O13
Net Charge 0
Average Mass 770.54600
Monoisotopic Mass 770.24079
InChI InChI=1S/C28H44N9O13.Fe/c1-16(39)35(48)10-4-7-19-25(44)29-14-24(43)32-22(15-38)26(45)30-13-23(42)31-20(8-5-11-36(49)17(2)40)27(46)34-21(28(47)33-19)9-6-12-37(50)18(3)41;/h19-22,38H,4-15H2,1-3H3,(H,29,44)(H,30,45)(H,31,42)(H,32,43)(H,33,47)(H,34,46);/q-3;+3/t19-,20-,21-,22-;/m0./s1
InChIKey FNBCUYMSQPYITB-JZVQUOAUSA-N
SMILES CC1=[O+][Fe-3]2345ON1CCC[C@@H]1NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCN(O2)C(C)=[O+]3)NC(=O)[C@H](CCCN(O4)C(C)=[O+]5)NC1=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via iron(III) hydroxamate )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ferricrocin (CHEBI:64492) has role metabolite (CHEBI:25212)
ferricrocin (CHEBI:64492) is a ferrichromes (CHEBI:61414)
IUPAC Name
(cyclo{glycyl-L-serylglycyl-N5-(hydroxy-κO)-N5-[1-(oxo-κO)ethyl]-L-ornithyl-N5-(hydroxy-κO)-N5-[1-(oxo-κO)ethyl]-L-ornithyl-N5-hydroxy-κO-N5-[1-(oxo-κO)ethyl]-L-ornithyl})iron
Synonym Source
(cyclic(glycyl-N5-acetyl-N5-hydroxy-L-ornithyl-N5-hydroxy-L-ornithyl-N5-acetyl-N5-hydroxy-L-ornithylgylcyl-L-seryl)ato(3−))iron ChemIDplus
Manual Xref Database
DB03574 DrugBank
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Registry Numbers Types Sources
14537062 Reaxys Registry Number Reaxys
23086-46-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11860025 PubMed citation Europe PMC
17586718 PubMed citation Europe PMC
19376908 PubMed citation Europe PMC
20943135 PubMed citation Europe PMC
21622789 PubMed citation Europe PMC
Last Modified
03 May 2012