CHEBI:133876 - S-acetylglutathione

ChEBI IDCHEBI:133876
ChEBI NameS-acetylglutathione
Stars
ASCII NameS-acetylglutathione
DefinitionAn S-acylglutathione in which the S-acyl group is specified as acetyl.
Last Modified6 March 2017
Submittergemma
DownloadsMolfile
FormulaC12H19N3O7S
Net Charge0
Average Mass349.365
Monoisotopic Mass349.09437
SMILESCC(=O)SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O
InChIInChI=1S/C12H19N3O7S/c1-6(16)23-5-8(11(20)14-4-10(18)19)15-9(17)3-2-7(13)12(21)22/h7-8H,2-5,13H2,1H3,(H,14,20)(H,15,17)(H,18,19)(H,21,22)/t7-,8-/m0/s1
InChIKeyFVRWSIPJNWXCEO-YUMQZZPRSA-N
Roles Classification
Biological Roles:
anti-HSV-1 agent  An anti-HSV agent agent that destroys or inhibits the replication of herpes simplex virus-1.
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
ChEBI Ontology
Outgoing Relation(s)
S-acetylglutathione (CHEBI:133876) has role anti-HSV-1 agent (CHEBI:64953)
S-acetylglutathione (CHEBI:133876) has role apoptosis inducer (CHEBI:68495)
S-acetylglutathione (CHEBI:133876) is a S-acylglutathione (CHEBI:18126)
IUPAC Name 
L-γ-glutamyl-S-acetyl-L-cysteinylglycine
Synonyms  Source
acetylglutathioneChEBI
S-acetyl-glutathioneChEBI
Manual XrefsDatabases
EP1154784Patent
WO0050060Patent
Registry NumbersSources
Reaxys:1717301Reaxys
CAS:3054-47-5ChemIDplus
Citations