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CHEBI:183014 - 1a,1b-Dihomo-PGF2alpha

ChEBI IDCHEBI:183014
ChEBI Name1a,1b-Dihomo-PGF2alpha
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H38O5
Net Charge0
Average Mass382.541
Monoisotopic Mass382.27192
SMILESCCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCCCC(=O)O)[C@@H](O)C[C@H]1O
InChIInChI=1S/C22H38O5/c1-2-3-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-4-5-7-10-13-22(26)27/h6,9,14-15,17-21,23-25H,2-5,7-8,10-13,16H2,1H3,(H,26,27)/b9-6-,15-14+/t17-,18+,19+,20-,21+/m0/s1
InChIKeyZCTAOAWRUXSOQF-GWSKAPOCSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) Esophagus (BTO:0000959) MetaboLights (MTBLS3014)
ChEBI Ontology
Outgoing Relation(s)
1a,1b-Dihomo-PGF2alpha (CHEBI:183014) is a prostanoid (CHEBI:26347)
IUPAC Name 
(Z)-9-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]non-7-enoic acid
Manual XrefsDatabases
4947774ChemSpider
LMFA03010157LIPID MAPS
Registry NumbersSources
CAS:57944-39-5ChemIDplus