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CHEBI:17842 - trypanothione
| Formula | C27H49N9O10S2 |
| Net Charge | 0 |
| Average Mass | 723.876 |
| Monoisotopic Mass | 723.30438 |
| SMILES | N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)NCCCCNCCCNC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(=O)O)C(=O)O |
| InChI | InChI=1S/C27H49N9O10S2/c28-16(26(43)44)4-6-20(37)35-18(14-47)24(41)33-12-22(39)31-10-2-1-8-30-9-3-11-32-23(40)13-34-25(42)19(15-48)36-21(38)7-5-17(29)27(45)46/h16-19,30,47-48H,1-15,28-29H2,(H,31,39)(H,32,40)(H,33,41)(H,34,42)(H,35,37)(H,36,38)(H,43,44)(H,45,46)/t16-,17-,18-,19-/m0/s1 |
| InChIKey | PHDOXVGRXXAYEB-VJANTYMQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| trypanothione (CHEBI:17842) has functional parent spermidine (CHEBI:16610) |
| trypanothione (CHEBI:17842) is a glutathione derivative (CHEBI:24337) |
| trypanothione (CHEBI:17842) is conjugate base of trypanothione(1+) (CHEBI:58290) |
| Incoming Relation(s) |
| trypanothione disulfide (CHEBI:35490) has functional parent trypanothione (CHEBI:17842) |
| trypanothione(1+) (CHEBI:58290) is conjugate acid of trypanothione (CHEBI:17842) |
| IUPAC Name |
|---|
| (2S,7R,26R,31S)-2,31-diamino-5,8,11,22,25,28-hexaoxo-7,26-bis(sulfanylmethyl)-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid |
| Synonyms | Source |
|---|---|
| Trypanothione | KEGG COMPOUND |
| N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine | KEGG COMPOUND |
| TSH | KEGG COMPOUND |
| Reduced trypanothione | KEGG COMPOUND |
| N1,N8-Bis-(glutathionyl)spermidine | KEGG COMPOUND |
| BIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINE | PDBeChem |