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CHEBI:165336 - PGF2alpha isopropyl ester

ChEBI IDCHEBI:165336
ChEBI NamePGF2alpha isopropyl ester
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H40O5
Net Charge0
Average Mass396.568
Monoisotopic Mass396.28757
SMILESCCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)OC(C)C)[C@@H](O)C[C@H]1O
InChIInChI=1S/C23H40O5/c1-4-5-8-11-18(24)14-15-20-19(21(25)16-22(20)26)12-9-6-7-10-13-23(27)28-17(2)3/h6,9,14-15,17-22,24-26H,4-5,7-8,10-13,16H2,1-3H3/b9-6-,15-14+/t18-,19+,20+,21-,22+/m0/s1
InChIKeyFPABVZYYTCHNMK-YNRDDPJXSA-N
ChEBI Ontology
Outgoing Relation(s)
PGF2alpha isopropyl ester (CHEBI:165336) is a prostanoid (CHEBI:26347)
IUPAC Name 
propan-2-yl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoate
Manual XrefsDatabases
4446203ChemSpider
LMFA03010076LIPID MAPS
Registry NumbersSources
CAS:53764-90-2ChemIDplus