CHEBI:133434 - 20,20,20-trihydroxyleukotriene B4(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 20,20,20-trihydroxyleukotriene B4(1−)
ChEBI ID CHEBI:133434
ChEBI ASCII Name 20,20,20-trihydroxyleukotriene B4(1-)
Definition A leukotriene anion that is the conjugate base of 20,20,20-trihydroxyleukotriene B4, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C20H31O7
Net Charge -1
Average Mass 383.457
Monoisotopic Mass 383.20753
InChI InChI=1S/C20H32O7/c21-17(11-6-2-1-5-9-16-20(25,26)27)12-7-3-4-8-13-18(22)14-10-15-19(23)24/h2-4,6-8,12-13,17-18,21-22,25-27H,1,5,9-11,14-16H2,(H,23,24)/p-1/b4-3+,6-2-,12-7+,13-8-/t17-,18-/m1/s1
InChIKey UZWWTCBNUQJEPB-QAASZIRWSA-M
SMILES C([C@H](/C=C/C=C/C=C\[C@H](CCCC([O-])=O)O)O)/C=C\CCCCC(O)(O)O
ChEBI Ontology
Outgoing 20,20,20-trihydroxyleukotriene B4(1−) (CHEBI:133434) is a leukotriene anion (CHEBI:62942)
20,20,20-trihydroxyleukotriene B4(1−) (CHEBI:133434) is conjugate base of 20,20,20-trihydroxyleukotriene B4 (CHEBI:134515)
Incoming 20,20,20-trihydroxyleukotriene B4 (CHEBI:134515) is conjugate acid of 20,20,20-trihydroxyleukotriene B4(1−) (CHEBI:133434)
IUPAC Name
(5S,6Z,8E,10E,12R,14Z)-5,12,20,20,20-pentahydroxyicosa-6,8,10,14-tetraenoate
Synonym Source
20-trihydroxy-leukotriene B4(1−) ChEBI
Last Modified
13 February 2017