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CHEBI:134619 - leukotriene C3

ChEBI IDCHEBI:134619
ChEBI Nameleukotriene C3
Stars
ASCII Nameleukotriene C3
DefinitionA leukotriene that is (5S,7E,9E,11Z)-5-hydroxyicosa-7,9,11-trienoic acid in which a glutathionyl group is attached at position 6 via a sulfide linkage.
Last Modified21 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC30H49N3O9S
Net Charge0
Average Mass627.801
Monoisotopic Mass627.31895
SMILESCCCCCCCC/C=C\C=C\C=C\[C@@H](SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)[C@@H](O)CCCC(=O)O
InChIInChI=1S/C30H49N3O9S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25(24(34)15-14-17-27(36)37)43-21-23(29(40)32-20-28(38)39)33-26(35)19-18-22(31)30(41)42/h9-13,16,22-25,34H,2-8,14-15,17-21,31H2,1H3,(H,32,40)(H,33,35)(H,36,37)(H,38,39)(H,41,42)/b10-9-,12-11+,16-13+/t22-,23-,24-,25+/m0/s1
InChIKeyAIJDQMYBRDJHHT-ABAXQOPJSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) - PubMed (2188748)
Mus musculus (ncbitaxon:10090) - PubMed (6780563)
Roles Classification
Biological Roles:
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
leukotriene C3 (CHEBI:134619) has role mouse metabolite (CHEBI:75771)
leukotriene C3 (CHEBI:134619) has role rat metabolite (CHEBI:86264)
leukotriene C3 (CHEBI:134619) is a glutathione derivative (CHEBI:24337)
leukotriene C3 (CHEBI:134619) is a leukotriene (CHEBI:25029)
leukotriene C3 (CHEBI:134619) is a organic sulfide (CHEBI:16385)
leukotriene C3 (CHEBI:134619) is conjugate acid of leukotriene C3(2−) (CHEBI:133597)
Incoming Relation(s)
leukotriene C3(2−) (CHEBI:133597) is conjugate base of leukotriene C3 (CHEBI:134619)
IUPAC Name 
L-γ-glutamyl-S-[(4S,5R,6E,8E,10Z)-1-carboxy-4-hydroxynonadeca-6,8,10-trien-5-yl]-L-cysteinylglycine
Synonyms  Source
Leukotriene C-3ChemIDplus
5-Hydroxy-6-S-glutathionyl-7,9,11-eicosatrienoic acidChemIDplus
LTC3ChEBI
Manual XrefsDatabases
EP0106571Patent
Registry NumbersSources
Reaxys:5686053Reaxys
CAS:77209-77-9ChemIDplus
Citations