CHEBI:133979 - prostaglandin D2 2-glyceryl ester

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ChEBI Name prostaglandin D2 2-glyceryl ester
ChEBI ID CHEBI:133979
ChEBI ASCII Name prostaglandin D2 2-glyceryl ester
Definition A 2-monoglyceride resulting from the condensation of the carboxy group of prostaglandin D2 with the 2-hydroxy group of glycerol.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter laimo
Supplier Information
Download Molfile XML SDF
Formula C23H38O7
Net Charge 0
Average Mass 426.545
Monoisotopic Mass 426.26175
InChI InChI=1S/C23H38O7/c1-2-3-6-9-17(26)12-13-20-19(21(27)14-22(20)28)10-7-4-5-8-11-23(29)30-18(15-24)16-25/h4,7,12-13,17-21,24-27H,2-3,5-6,8-11,14-16H2,1H3/b7-4-,13-12+/t17-,19+,20+,21-/m0/s1
InChIKey OCYWGBZEVKVWBQ-PQGWWSFGSA-N
SMILES C(\C[C@H]1[C@H](CC([C@@H]1/C=C/[C@H](CCCCC)O)=O)O)=C\CCCC(=O)OC(CO)CO
Metabolite of Species Details
Homo Sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing prostaglandin D2 2-glyceryl ester (CHEBI:133979) has functional parent prostaglandin D2 (CHEBI:15555)
prostaglandin D2 2-glyceryl ester (CHEBI:133979) has role human xenobiotic metabolite (CHEBI:76967)
prostaglandin D2 2-glyceryl ester (CHEBI:133979) is a 2-monoglyceride (CHEBI:17389)
prostaglandin D2 2-glyceryl ester (CHEBI:133979) is a alicyclic ketone (CHEBI:36132)
prostaglandin D2 2-glyceryl ester (CHEBI:133979) is a prostaglandins D (CHEBI:26337)
prostaglandin D2 2-glyceryl ester (CHEBI:133979) is a secondary allylic alcohol (CHEBI:134396)
IUPAC Name
1,3-dihydroxypropan-2-yl (5Z,13E,15S)-9α,15-dihydroxy-11-oxoprosta-5,13-dien-1-oate
Synonyms Sources
2-glyceryl (9α,15S)-dihydroxy-11-oxo-(5Z,13E)-icosadienoate SUBMITTER
2-glyceryl-prostaglandin D2 UniProt
Citation Waiting for Citations Type Source
12244105 PubMed citation SUBMITTER
Last Modified
21 March 2017