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CHEBI:57403 - prostaglandin I2(1−)

ChEBI IDCHEBI:57403
ChEBI Nameprostaglandin I2(1−)
Stars
ASCII Nameprostaglandin I2(1-)
DefinitionConjugate base of prostaglandin I2.
Last Modified24 April 2015
DownloadsMolfile
FormulaC20H31O5
Net Charge-1
Average Mass351.463
Monoisotopic Mass351.21770
SMILES[H][C@]12C[C@@H](O)[C@H](/C=C/[C@@H](O)CCCCC)[C@@]1([H])C/C(=C/CCCC(=O)[O-])O2
InChIInChI=1S/C20H32O5/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/h8,10-11,14,16-19,21-22H,2-7,9,12-13H2,1H3,(H,23,24)/p-1/b11-10+,15-8-/t14-,16+,17+,18+,19-/m0/s1
InChIKeyKAQKFAOMNZTLHT-OZUDYXHBSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
prostaglandin I2(1−) (CHEBI:57403) has role human metabolite (CHEBI:77746)
prostaglandin I2(1−) (CHEBI:57403) is a prostaglandin carboxylic acid anion (CHEBI:59326)
prostaglandin I2(1−) (CHEBI:57403) is conjugate base of prostaglandin I2 (CHEBI:15552)
Incoming Relation(s)
19-hydroxyprostaglandin I2(1−) (CHEBI:137987) has functional parent prostaglandin I2(1−) (CHEBI:57403)
prostaglandin I2 (CHEBI:15552) is conjugate acid of prostaglandin I2(1−) (CHEBI:57403)
IUPAC Name 
(5Z,13E,15S)-6,9α-epoxy-11α,15-dihydroxyprosta-5,13-dienoate
Synonym  Source
prostaglandin I2 anionChEBI
UniProt Name  Source
prostaglandin I2UniProt
Registry NumbersSources
Beilstein:8135954Beilstein