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CHEBI:85072 - 15-dehydroprostaglandin A1(1−)

ChEBI IDCHEBI:85072
ChEBI Name15-dehydroprostaglandin A1(1−)
Stars
ASCII Name15-dehydroprostaglandin A1(1-)
DefinitionA prostaglandin carboxylic acid anion that is the conjugate base of 15-dehydro-prostaglandin A1, obtained by deprotonation of the carboxy group.; major species at pH 7.3.
Last Modified29 July 2021
Submitternhn
DownloadsMolfile
FormulaC20H29O4
Net Charge-1
Average Mass333.448
Monoisotopic Mass333.20713
SMILESCCCCCC(=O)/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)[O-]
InChIInChI=1S/C20H30O4/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/h12-16,18H,2-11H2,1H3,(H,23,24)/p-1/b14-12+/t16-,18+/m0/s1
InChIKeyYKXHFAJZOFTAOC-DTXSUPOZSA-M
ChEBI Ontology
Outgoing Relation(s)
15-dehydroprostaglandin A1(1−) (CHEBI:85072) has functional parent prostaglandin A1(1−) (CHEBI:57398)
15-dehydroprostaglandin A1(1−) (CHEBI:85072) is a prostaglandin carboxylic acid anion (CHEBI:59326)
15-dehydroprostaglandin A1(1−) (CHEBI:85072) is conjugate base of 15-dehydroprostaglandin A1 (CHEBI:85552)
Incoming Relation(s)
15-dehydroprostaglandin A1 (CHEBI:85552) is conjugate acid of 15-dehydroprostaglandin A1(1−) (CHEBI:85072)
IUPAC Name 
(13E)-9,15-dioxoprosta-10,13-dien-1-oate
UniProt Name  Source
15-oxo-prostaglandin A1UniProt
Citations