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CHEBI:214234 - Desferriferrichrome

ChEBI IDCHEBI:214234
ChEBI NameDesferriferrichrome
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H45N9O12
Net Charge0
Average Mass687.708
Monoisotopic Mass687.31877
SMILESCC(=O)N(O)CCCC1NC(=O)CNC(=O)CNC(=O)CNC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CCCN(O)C(C)=O)NC1=O
InChIInChI=1S/C27H45N9O12/c1-16(37)34(46)10-4-7-19-25(43)30-14-23(41)28-13-22(40)29-15-24(42)31-20(8-5-11-35(47)17(2)38)26(44)33-21(27(45)32-19)9-6-12-36(48)18(3)39/h19-21,46-48H,4-15H2,1-3H3,(H,28,41)(H,29,40)(H,30,43)(H,31,42)(H,32,45)(H,33,44)
InChIKeyZFDAUYPBCXMSBF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas aeruginosa (ncbitaxon:287) - PubMed (20047910)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Desferriferrichrome (CHEBI:214234) is a oligopeptide (CHEBI:25676)
IUPAC Name 
N-[3-[5,8-bis[3-[acetyl(hydroxy)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-N-hydroxyacetamide
Manual XrefsDatabases
4883374ChemSpider