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CHEBI:133393 - prostaglandin B1(1−)

Default Structure
ChEBI IDCHEBI:133393
ChEBI Nameprostaglandin B1(1−)
Stars
ASCII Nameprostaglandin B1(1-)
DefinitionA prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin B1, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified26 February 2024
Submitterabridge
DownloadsMolfile
FormulaC20H31O4
Net Charge-1
Average Mass335.464
Monoisotopic Mass335.22278
SMILESCCCCC[C@H](O)/C=C/C1=C(CCCCCCC(=O)[O-])C(=O)CC1
InChIInChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12,14,17,21H,2-11,13,15H2,1H3,(H,23,24)/p-1/b14-12+/t17-/m0/s1
InChIKeyYBHMPNRDOVPQIN-VSOYFRJCSA-M
ChEBI Ontology
Outgoing Relation(s)
prostaglandin B1(1−) (CHEBI:133393) is a prostaglandin carboxylic acid anion (CHEBI:59326)
prostaglandin B1(1−) (CHEBI:133393) is conjugate base of prostaglandin B1 (CHEBI:27624)
Incoming Relation(s)
prostaglandin B1 (CHEBI:27624) is conjugate acid of prostaglandin B1(1−) (CHEBI:133393)
IUPAC Name 
(13E,15S)-15-hydroxy-9-oxoprosta-8(12),13-dien-1-oate
Synonyms  Source
PGB1SUBMITTER
Prostaglandin B1SUBMITTER
UniProt Name  Source
prostaglandin B1UniProt