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CHEBI:168478 - ent-16-epi-16-J1-PhytoP

ChEBI IDCHEBI:168478
ChEBI Nameent-16-epi-16-J1-PhytoP
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O4
Net Charge0
Average Mass308.418
Monoisotopic Mass308.19876
SMILESCC[C@H](O)/C=C/[C@@H]1C(=O)C=C[C@@H]1CCCCCCCC(=O)O
InChIInChI=1S/C18H28O4/c1-2-15(19)11-12-16-14(10-13-17(16)20)8-6-4-3-5-7-9-18(21)22/h10-16,19H,2-9H2,1H3,(H,21,22)/b12-11+/t14-,15-,16-/m0/s1
InChIKeyFWGSZKXOWWJSMJ-LCSYVEKBSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
ent-16-epi-16-J1-PhytoP (CHEBI:168478) is a prostanoid (CHEBI:26347)
IUPAC Name 
8-[(1S,5S)-5-[(E,3S)-3-hydroxypent-1-enyl]-4-oxocyclopent-2-en-1-yl]octanoic acid
Manual XrefsDatabases
LMFA02030072LIPID MAPS