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CHEBI:57407 - 15-dehydro-prostaglandin I2(1−)

ChEBI IDCHEBI:57407
ChEBI Name15-dehydro-prostaglandin I2(1−)
Stars
ASCII Name15-dehydro-prostaglandin I2(1-)
DefinitionConjugate base of 15-dehydro-prostaglandin I2.
Last Modified13 November 2017
DownloadsMolfile
FormulaC20H29O5
Net Charge-1
Average Mass349.447
Monoisotopic Mass349.20205
SMILES[H][C@]12C[C@@H](O)[C@H](/C=C/C(=O)CCCCC)[C@@]1([H])C/C(=C/CCCC(=O)[O-])O2
InChIInChI=1S/C20H30O5/c1-2-3-4-7-14(21)10-11-16-17-12-15(8-5-6-9-20(23)24)25-19(17)13-18(16)22/h8,10-11,16-19,22H,2-7,9,12-13H2,1H3,(H,23,24)/p-1/b11-10+,15-8-/t16-,17-,18-,19+/m1/s1
InChIKeyYCLHGWBUIYKBPM-ABXKVQRYSA-M
ChEBI Ontology
Outgoing Relation(s)
15-dehydro-prostaglandin I2(1−) (CHEBI:57407) is a prostaglandin carboxylic acid anion (CHEBI:59326)
15-dehydro-prostaglandin I2(1−) (CHEBI:57407) is conjugate base of 15-dehydro-prostaglandin I2 (CHEBI:15556)
Incoming Relation(s)
15-dehydro-prostaglandin I2 (CHEBI:15556) is conjugate acid of 15-dehydro-prostaglandin I2(1−) (CHEBI:57407)
IUPAC Name 
(5Z,13E)-6,9α-epoxy-11α-hydroxy-15-oxoprosta-5,13-dienoate
UniProt Name  Source
15-dehydro-prostaglandin I2UniProt