EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:32711 - 4-hydroxynonenal glutathione conjugate

ChEBI IDCHEBI:32711
ChEBI Name4-hydroxynonenal glutathione conjugate
Stars
Last Modified12 December 2007
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H33N3O8S
Net Charge0
Average Mass463.553
Monoisotopic Mass463.19884
SMILESCCCCCC1OC(O)CC1SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O
InChIInChI=1S/C19H33N3O8S/c1-2-3-4-5-13-14(8-17(26)30-13)31-10-12(18(27)21-9-16(24)25)22-15(23)7-6-11(20)19(28)29/h11-14,17,26H,2-10,20H2,1H3,(H,21,27)(H,22,23)(H,24,25)(H,28,29)/t11-,12-,13?,14?,17?/m0/s1
InChIKeyICRIFHIWWXQBPY-RQRWYUMJSA-N
ChEBI Ontology
Outgoing Relation(s)
4-hydroxynonenal glutathione conjugate (CHEBI:32711) is a glutathione derivative (CHEBI:24337)
4-hydroxynonenal glutathione conjugate (CHEBI:32711) is a tetrahydrofuranol (CHEBI:47017)
Incoming Relation(s)
L-γ-glutamyl-S-[(2S,3S,5R)-5-hydroxy-2-pentyltetrahydrofuran-3-yl]-L-cysteinylglycine (CHEBI:43144) is a 4-hydroxynonenal glutathione conjugate (CHEBI:32711)
IUPAC Name 
L-γ-glutamyl-S-(5-hydroxy-2-pentyltetrahydrofuran-3-yl)-L-cysteinylglycine
Synonyms  Source
4-hydroxy-2,3-trans-nonenal glutathione conjugateChemIDplus
GS-HNEChEBI
Registry NumbersSources
Beilstein:9302833Beilstein