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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1a,1b-Dihomo-PGF2alpha
ChEBI ID CHEBI:183014
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H38O5
Net Charge 0
Average Mass 382.541
Monoisotopic Mass 382.27192
InChI InChI=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
InChIKey ZCTAOAWRUXSOQF-GWSKAPOCSA-N
SMILES O[C@@H]1[C@@H]([C@H]([C@H](O)C1)/C=C/[C@@H](O)CCCCC)C/C=C\CCCCCC(O)=O
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in Esophagus (BTO:0000959). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xrefs Databases
4947774 ChemSpider
LMFA03010157 LIPID MAPS
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Registry Number Type Source
57944-39-5 CAS Registry Number ChemIDplus