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CHEBI:231009 - 9-F1-phytoprostane

ChEBI IDCHEBI:231009
ChEBI Name9-F1-phytoprostane
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O5
Net Charge0
Average Mass328.449
Monoisotopic Mass328.22497
SMILESCC[C@@H]1[C@H](/C=C/[C@H](O)CCCCCCCC(=O)O)[C@@H](O)C[C@@H]1O
InChIInChI=1S/C18H32O5/c1-2-14-15(17(21)12-16(14)20)11-10-13(19)8-6-4-3-5-7-9-18(22)23/h10-11,13-17,19-21H,2-9,12H2,1H3,(H,22,23)/b11-10+/t13-,14-,15+,16+,17+/m1/s1
InChIKeyGKBLNJXQDMHILB-WBWYXKPPSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
9-F1-phytoprostane (CHEBI:231009) is a prostanoid (CHEBI:26347)
IUPAC Name 
(E,9R)-11-[(1S,2R,3S,5S)-2-ethyl-3,5-dihydroxycyclopentyl]-9-hydroxyundec-10-enoic acid
Manual XrefsDatabases
HMDB0304641HMDB