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CHEBI:140285 - prostaglandin J3(1−)

ChEBI IDCHEBI:140285
ChEBI Nameprostaglandin J3(1−)
Stars
ASCII Nameprostaglandin J3(1-)
DefinitionA prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin J3. obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified27 February 2018
SubmitterSteve
DownloadsMolfile
FormulaC20H27O4
Net Charge-1
Average Mass331.432
Monoisotopic Mass331.19148
SMILESCC/C=C\C[C@H](O)/C=C/[C@H]1C(=O)C=C[C@@H]1C/C=C\CCCC(=O)[O-]
InChIInChI=1S/C20H28O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h3-4,6-7,12-18,21H,2,5,8-11H2,1H3,(H,23,24)/p-1/b6-3-,7-4-,14-13+/t16-,17-,18+/m0/s1
InChIKeyDIBKBAMSPPKSTJ-BAILPSPNSA-M
ChEBI Ontology
Outgoing Relation(s)
prostaglandin J3(1−) (CHEBI:140285) is a prostaglandin carboxylic acid anion (CHEBI:59326)
prostaglandin J3(1−) (CHEBI:140285) is conjugate base of prostaglandin J3 (CHEBI:140267)
Incoming Relation(s)
prostaglandin J3 (CHEBI:140267) is conjugate acid of prostaglandin J3(1−) (CHEBI:140285)
IUPAC Name 
(5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoate
Synonyms  Source
(5Z,9Z,13E,15S,17Z)-hydroxy-11-oxoprostatetraenoateChEBI
PGJ3(1−)ChEBI