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CHEBI:229786 - 8-iso-prostaglandin F2α-glucuronide(2−)

ChEBI IDCHEBI:229786
ChEBI Name8-iso-prostaglandin F2α-glucuronide(2−)
Stars
ASCII Name8-iso-prostaglandin F2alpha-glucuronide(2-)
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC26H40O11
Net Charge-2
Average Mass528.595
Monoisotopic Mass528.25816
SMILESCCCCC[C@@H](/C=C/[C@@H]1[C@H](C/C=C\CCCC(=O)[O-])[C@@H](O)C[C@H]1O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C26H42O11/c1-2-3-6-9-15(36-26-23(33)21(31)22(32)24(37-26)25(34)35)12-13-17-16(18(27)14-19(17)28)10-7-4-5-8-11-20(29)30/h4,7,12-13,15-19,21-24,26-28,31-33H,2-3,5-6,8-11,14H2,1H3,(H,29,30)(H,34,35)/p-2/b7-4-,13-12+/t15-,16-,17+,18-,19+,21-,22-,23+,24-,26+/m0/s1
InChIKeyNLZULYVCGNMYSF-CKBSYWFFSA-L
Roles Classification
Application:
biomarker  A substance used as an indicator of a biological state.
ChEBI Ontology
Outgoing Relation(s)
8-iso-prostaglandin F2α-glucuronide(2−) (CHEBI:229786) has functional parent 8-epi-prostaglandin F2α(1−) (CHEBI:77768)
8-iso-prostaglandin F2α-glucuronide(2−) (CHEBI:229786) is a F2-isoprostane (CHEBI:142058)
8-iso-prostaglandin F2α-glucuronide(2−) (CHEBI:229786) is a glucosiduronic acid (CHEBI:24302)
8-iso-prostaglandin F2α-glucuronide(2−) (CHEBI:229786) is a prostaglandin carboxylic acid anion (CHEBI:59326)
Synonyms  Source
8-iso-PGF2α-glucuronide(2−)SUBMITTER
8-isoprostane-glucuronide(2−)SUBMITTER
15-F2t-IsoP-glucuronide(2−)SUBMITTER
iPF2α-III-glucuronide(2−)SUBMITTER
UniProt Name  Source
8-iso-prostaglandin F2α-glucuronideUniProt
Citations