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CHEBI:137383 - 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)

ChEBI IDCHEBI:137383
ChEBI Name20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)
Stars
ASCII Name20-hydroxy-20-oxoleukotriene B4-20-(beta-D-glucuronide)
DefinitionAn O-acyl carbohydrate obtained by the formal condensation of the 20-carboxy group of 20-hydroxy-20-oxoleukotriene B4 with the anomeric hydroxy group of β-D-glucuronic acid.
Last Modified8 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC26H38O12
Net Charge0
Average Mass542.578
Monoisotopic Mass542.23633
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)/b5-4+,6-2-,12-7+,13-8-/t17-,18-,21+,22+,23-,24+,26-/m1/s1
InChIKeyUAMFSIWNQKWRCK-QWILEGIPSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) has functional parent 20-hydroxy-20-oxoleukotriene B4 (CHEBI:27562)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) is a O-acyl carbohydrate (CHEBI:52782)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) is a dicarboxylic acid (CHEBI:35692)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) is a glucosiduronic acid (CHEBI:24302)
20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide) (CHEBI:137383) is a leukotriene (CHEBI:25029)
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)
Incoming Relation(s)
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)
IUPAC Name 
1-O-[(6Z,9R,10E,12E,14Z,16S)-19-carboxy-9,16-dihydroxynonadeca-6,10,12,14-tetraenoyl]-β-D-glucopyranuronic acid
Synonym  Source
20-carboxyleukotriene B4-20-(β-D-glucuronide)ChEBI