EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:165319 - 1-Glyceryl-PGE2

ChEBI IDCHEBI:165319
ChEBI Name1-Glyceryl-PGE2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H38O7
Net Charge0
Average Mass426.550
Monoisotopic Mass426.26175
SMILESCCCCC[C@H](O)/C=C/[C@H]1[C@@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)OC[C@H](O)CO
InChIInChI=1S/C23H38O7/c1-2-3-6-9-17(25)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-16-18(26)15-24/h4,7,12-13,17-20,22,24-26,28H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,18+,19+,20+,22-/m0/s1
InChIKeyRJXVYMMSQBYEHN-SDTVLRMPSA-N
ChEBI Ontology
Outgoing Relation(s)
1-Glyceryl-PGE2 (CHEBI:165319) is a prostanoid (CHEBI:26347)
IUPAC Name 
[(2R)-2,3-dihydroxypropyl] (Z)-7-[(1R,2R,3S)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoate
Manual XrefsDatabases
30776691ChemSpider
HMDB0013043HMDB