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CHEBI:191260 - 15-methyl-15R-PGF2alpha methyl ester

ChEBI IDCHEBI:191260
ChEBI Name15-methyl-15R-PGF2alpha methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H38O5
Net Charge0
Average Mass382.541
Monoisotopic Mass382.27192
SMILESCCCCC[C@](C)(O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)OC)[C@@H](O)C[C@H]1O
InChIInChI=1S/C22H38O5/c1-4-5-10-14-22(2,26)15-13-18-17(19(23)16-20(18)24)11-8-6-7-9-12-21(25)27-3/h6,8,13,15,17-20,23-24,26H,4-5,7,9-12,14,16H2,1-3H3/b8-6-,15-13+/t17-,18-,19+,20-,22+/m1/s1
InChIKeyQQCOAAFKJZXJFP-XAYIDPIISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
15-methyl-15R-PGF2alpha methyl ester (CHEBI:191260) is a prostanoid (CHEBI:26347)
IUPAC Name 
methyl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-3-methyloct-1-enyl]cyclopentyl]hept-5-enoate
Manual XrefsDatabases
LMFA03010122LIPID MAPS
4446231ChemSpider
D03399KEGG DRUG
Registry NumbersSources
CAS:35700-21-1ChemIDplus