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CHEBI:211033 - Acinetobactin

ChEBI IDCHEBI:211033
ChEBI NameAcinetobactin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18N4O5
Net Charge0
Average Mass346.343
Monoisotopic Mass346.12772
SMILESCC1OC(c2cccc(O)c2O)=NC1C(=O)N(O)CCc1cncn1
InChIInChI=1S/C16H18N4O5/c1-9-13(16(23)20(24)6-5-10-7-17-8-18-10)19-15(25-9)11-3-2-4-12(21)14(11)22/h2-4,7-9,13,21-22,24H,5-6H2,1H3,(H,17,18)
InChIKeyFCWIGDCVHNNXFS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Acinetobacter baumannii (ncbitaxon:470) - DOI (10.1007/bf00301846)
ChEBI Ontology
Outgoing Relation(s)
Acinetobactin (CHEBI:211033) has functional parent α-amino acid (CHEBI:33704)
Acinetobactin (CHEBI:211033) is a organonitrogen compound (CHEBI:35352)
Acinetobactin (CHEBI:211033) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
2-(2,3-dihydroxyphenyl)-N-hydroxy-N-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide
Manual XrefsDatabases
64881764ChemSpider