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

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ChEBI Name 20-hydroxy-20-oxoleukotriene B4-20-(β-D-glucuronide)
ChEBI ID CHEBI:137383
ChEBI ASCII Name 20-hydroxy-20-oxoleukotriene B4-20-(beta-D-glucuronide)
Definition An 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C26H38O12
Net Charge 0
Average Mass 542.574
Monoisotopic Mass 542.23633
InChI InChI=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
InChIKey UAMFSIWNQKWRCK-QWILEGIPSA-N
SMILES C([C@H](/C=C/C=C/C=C\[C@H](CCCC(O)=O)O)O)/C=C\CCCCC(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(O)=O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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
Last Modified
08 June 2017