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CHEBI:136546 - 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−)

ChEBI IDCHEBI:136546
ChEBI Name20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−)
Stars
ASCII Name20-hydroxy-20-oxoleukotriene B4-20-(beta-D-glucuronide)(2-)
DefinitionA leukotriene anion obtained by deprotonation of the carboxylic acid functions of 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide); major species at pH 7.3.
Last Modified8 June 2017
Submitternhn
DownloadsMolfile
FormulaC26H36O12
Net Charge-2
Average Mass540.562
Monoisotopic Mass540.22177
SMILESO=C([O-])CCC[C@H](O)/C=C\C=C\C=C\[C@H](O)C/C=C\CCCCC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C26H38O12/c27-17(12-7-4-5-8-13-18(28)14-10-15-19(29)30)11-6-2-1-3-9-16-20(31)37-26-23(34)21(32)22(33)24(38-26)25(35)36/h2,4-8,12-13,17-18,21-24,26-28,32-34H,1,3,9-11,14-16H2,(H,29,30)(H,35,36)/p-2/b5-4+,6-2-,12-7+,13-8-/t17-,18-,21+,22+,23-,24+,26-/m1/s1
InChIKeyUAMFSIWNQKWRCK-QWILEGIPSA-L
ChEBI Ontology
Outgoing Relation(s)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−) (CHEBI:136546) is a carbohydrate acid derivative anion (CHEBI:63551)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−) (CHEBI:136546) is a dicarboxylic acid dianion (CHEBI:28965)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−) (CHEBI:136546) is a leukotriene anion (CHEBI:62942)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−) (CHEBI:136546) is conjugate base of 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383)
Incoming Relation(s)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) is conjugate acid of 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)(2−) (CHEBI:136546)
IUPAC Name 
1-O-[(6Z,9R,10E,12E,14Z,16S)-19-carboxylato-9,16-dihydroxynonadeca-6,10,12,14-tetraenoyl]-β-D-glucopyranuronate
Synonyms  Source
20-oxo-leukotriene B4-20-O-(β-D-glucuronide)(2−)SUBMITTER
20-carboxyleukotriene B4-20-(β-D-glucuronide)(2−)ChEBI
UniProt Name  Source
20-oxo-leukotriene B4 20-O-(β-D-glucuronate)UniProt
Citations