Term: | trypanothione |
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Accession: | CHEBI:17842
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Definition: | A glutathione derivative that has formula C27H49N9O10S2. |
Synonyms: | exact_synonym: | (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 |
| related_synonym: | (2S,7R,26R,31S)-2,31-diamino-7,26-bis(mercaptomethyl)-5,8,11,22,25,28-hexaoxo-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid; BIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINE; Formula=C27H49N9O10S2; 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; N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine; N1,N8-Bis(glutathionyl)spermidine; Reduced trypanothione; 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; TSH; Trypanothion |
| alt_id: | CHEBI:12620; CHEBI:12621; CHEBI:15034; CHEBI:15272; CHEBI:26528; CHEBI:27160; CHEBI:42644; CHEBI:9764 |
| xref: | Beilstein:6559471; CAS:96304-42-6; DrugBank:DB03470; KEGG:C02090 |
| xref_mesh: | MESH:C044809 |
| xref: | PDBeChem:GCG |
| cyclic_relationship: | is_conjugate_base_of CHEBI:58290 |
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