CHEBI:16613 - glutathionylspermidine

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ChEBI Name glutathionylspermidine
ChEBI ID CHEBI:16613
Definition The spermidine amide of glutathione.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:46146, CHEBI:12624, CHEBI:14329, CHEBI:24341, CHEBI:5438
Supplier Information
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Formula C17H34N6O5S
Net Charge 0
Average Mass 434.55530
Monoisotopic Mass 434.231
InChI InChI=1S/C17H34N6O5S/c18-6-1-2-7-20-8-3-9-21-15(25)10-22-16(26)13(11-29)23-14(24)5-4-12(19)17(27)28/h12-13,20,29H,1-11,18-19H2,(H,21,25)(H,22,26)(H,23,24)(H,27,28)/t12-,13-/m0/s1
InChIKey NEDQLXHBVHSKNV-STQMWFEESA-N
SMILES NCCCCNCCCNC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(O)=O
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing glutathionylspermidine (CHEBI:16613) has functional parent spermidine (CHEBI:16610)
glutathionylspermidine (CHEBI:16613) has role Escherichia coli metabolite (CHEBI:76971)
glutathionylspermidine (CHEBI:16613) is a glutathione derivative (CHEBI:24337)
glutathionylspermidine (CHEBI:16613) is conjugate base of glutathionylspermidinium(2+) (CHEBI:57835)
Incoming glutathionylspermidinium(2+) (CHEBI:57835) is conjugate acid of glutathionylspermidine (CHEBI:16613)
IUPAC Name
L-γ-glutamyl-L-cysteinyl-N-{3-[(4-aminobutyl)amino]propyl}glycinamide
Synonyms Sources
Glutathionylspermidine KEGG COMPOUND
N1-(gamma-L-Glutamyl-L-cysteinyl-glycyl)-spermidine KEGG COMPOUND
Manual Xrefs Databases
C05730 KEGG COMPOUND
DB03295 DrugBank
View more database links
Registry Numbers Types Sources
33932-35-3 CAS Registry Number ChemIDplus
6540906 Beilstein Registry Number Beilstein
Last Modified
25 January 2016