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CHEBI:230003 - 15(R)-Methylprostaglandin A2

ChEBI IDCHEBI:230003
ChEBI Name15(R)-Methylprostaglandin A2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O4
Net Charge0
Average Mass348.483
Monoisotopic Mass348.23006
SMILESCCCCCC(C)(O)/C=C/[C@H]1C=CC(=O)C1C/C=C\CCCC(=O)O
InChIInChI=1S/C21H32O4/c1-3-4-9-15-21(2,25)16-14-17-12-13-19(22)18(17)10-7-5-6-8-11-20(23)24/h5,7,12-14,16-18,25H,3-4,6,8-11,15H2,1-2H3,(H,23,24)/b7-5-,16-14+/t17-,18?,21?/m1/s1
InChIKeyUEBXYYKXJUBAJX-JGBOPYMCSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
15(R)-Methylprostaglandin A2 (CHEBI:230003) is a prostanoid (CHEBI:26347)
IUPAC Name 
(Z)-7-[(2S)-2-[(E)-3-hydroxy-3-methyloct-1-enyl]-5-oxocyclopent-3-en-1-yl]hept-5-enoic acid