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CHEBI:26634 - selenodiglutathione

Default Structure
ChEBI IDCHEBI:26634
ChEBI Nameselenodiglutathione
Stars
DefinitionA thioselenide in which a selenium atom is attached to the sulfur atoms of two molecules of glutathione. It is an initial metabolite of selenite, SeO32−.
Last Modified25 January 2016
DownloadsMolfile
FormulaC20H32N6O12S2Se
Net Charge0
Average Mass691.600
Monoisotopic Mass692.06848
SMILESN[C@@H](CCC(=O)N[C@@H](CS[Se]SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O)C(=O)O
InChIInChI=1S/C20H32N6O12S2Se/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-41-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1
InChIKeyGJEZZQVPWMCGSB-BJDJZHNGSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
selenodiglutathione (CHEBI:26634) has functional parent glutathioselenol (CHEBI:64729)
selenodiglutathione (CHEBI:26634) has role Escherichia coli metabolite (CHEBI:76971)
selenodiglutathione (CHEBI:26634) has role metabolite (CHEBI:25212)
selenodiglutathione (CHEBI:26634) is a glutathione derivative (CHEBI:24337)
selenodiglutathione (CHEBI:26634) is a thioselenide (CHEBI:64726)
selenodiglutathione (CHEBI:26634) is conjugate acid of selenodiglutathione(2−) (CHEBI:71259)
Incoming Relation(s)
selenodiglutathione(2−) (CHEBI:71259) is conjugate base of selenodiglutathione (CHEBI:26634)
Synonyms  Source
N,N'-((selenodithio)bis(1-((carboxymethyl)carbamoyl)ethylene))di-L-glutamineChEBI
N,N'-[(selenodithio)bis{1-[(carboxymethyl)carbamoyl]ethylene}]di-L-glutamineChEBI
GS-Se-SGChEBI
GSSeSGKEGG COMPOUND
Manual XrefsDatabases
c0743UM-BBD
C18870KEGG COMPOUND
CPD-13908MetaCyc
Registry NumbersSources
Reaxys:13876743Reaxys
CAS:33944-90-0ChemIDplus
Citations