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CHEBI:220389 - Fimsbactin F

ChEBI IDCHEBI:220389
ChEBI NameFimsbactin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26N4O8
Net Charge0
Average Mass438.437
Monoisotopic Mass438.17506
SMILESCC(=O)N(O)CCCCNC(=O)[C@H](CO)NC(=O)[C@@H]1COC(c2cccc(O)c2O)=N1
InChIInChI=1S/C19H26N4O8/c1-11(25)23(30)8-3-2-7-20-17(28)13(9-24)21-18(29)14-10-31-19(22-14)12-5-4-6-15(26)16(12)27/h4-6,13-14,24,26-27,30H,2-3,7-10H2,1H3,(H,20,28)(H,21,29)/t13-,14-/m0/s1
InChIKeyWWDGEKDKGZGKAG-KBPBESRZSA-N
Species of MetaboliteComponentSourceComments
Acinetobacter baumannii ATCC 17978 (ncbitaxon:400667) - PubMed (23456955)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Fimsbactin F (CHEBI:220389) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
(4S)-N-[(2S)-1-[4-[acetyl(hydroxy)amino]butylamino]-3-hydroxy-1-oxopropan-2-yl]-2-(2,3-dihydroxyphenyl)-4,5-dihydro-1,3-oxazole-4-carboxamide
Manual XrefsDatabases
78440283ChemSpider