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CHEBI:32639 - acetaminophen glutathione conjugate

ChEBI IDCHEBI:32639
ChEBI Nameacetaminophen glutathione conjugate
Stars
Last Modified11 August 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H24N4O8S
Net Charge0
Average Mass456.477
Monoisotopic Mass456.13148
SMILESCC(=O)Nc1ccc(O)c(SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)c1
InChIInChI=1S/C18H24N4O8S/c1-9(23)21-10-2-4-13(24)14(6-10)31-8-12(17(28)20-7-16(26)27)22-15(25)5-3-11(19)18(29)30/h2,4,6,11-12,24H,3,5,7-8,19H2,1H3,(H,20,28)(H,21,23)(H,22,25)(H,26,27)(H,29,30)/t11-,12-/m0/s1
InChIKeyVFNAXGMNFCUWCI-RYUDHWBXSA-N
ChEBI Ontology
Outgoing Relation(s)
acetaminophen glutathione conjugate (CHEBI:32639) has functional parent paracetamol (CHEBI:46195)
acetaminophen glutathione conjugate (CHEBI:32639) is a glutathione derivative (CHEBI:24337)
IUPAC Name 
L-γ-glutamyl-S-(5-acetamido-2-hydroxyphenyl)-L-cysteinylglycine
Synonyms  Source
3-(Glutathion-S-yl)acetaminophenChemIDplus
Acetaminophen glutathionChemIDplus
Glutathione-S-acetaminophen conjugateChemIDplus
AA-GlutathionChemIDplus
AA-GshChemIDplus