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trypanothione

Properties

Image

Occurences in reactions

MNX_ID

MNXM1596

	#reac
in my sandbox	0
in MNXref (generic)	19
in models (compartimentalized)	1

formula

C₂₇H₅₀N₉O₁₀S₂

charge

mass

724.31166

reference

chebi:58290

InChIKey

PHDOXVGRXXAYEB-VJANTYMQSA-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)/p+1/t16-,17-,18-,19-/m0/s1

SMILES

[NH3+][C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)NCCCC[NH2+]CCCNC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58290 chebi:58290	trypanothione (2S,7R,26R,31S)-2,31-diazaniumyl-5,8,11,22,25,28-hexaoxo-7,26-bis(sulfanylmethyl)-6,9,12,21,24,27-hexaaza-16-azoniadotriacontane-1,32-dioate trypanothione cation trypanothione(1+)
sabiork.compound:2688 sabiorkM:2688	Reduced trypanothione N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine N1,N8-Bis-(glutathionyl)spermidine TSH Trypanothione
seed.compound:cpd01418 seedM:cpd01418	TSH N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine N1,N8-Bis(glutathionyl)spermidine N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine N1,N8-Bis-(glutathionyl)spermidine N1,N8-bis(glutathion-S-yl)spermidine N1,N8-bis(glutathionyl)spermidine N1,N8-bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine Reduced trypanothione Trypanothione trypanothione
hmdb:HMDB0060520	Trypanothione (2S)-2-amino-4-{[(1R)-1-{[({3-[(4-{2-[(2R)-2-[(4S)-4-amino-4-carboxybutanamido]-3-sulfanylpropanamido]acetamido}butyl)amino]propyl}carbamoyl)methyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid (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-dioate (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 BIS(g-glutamyl-cysteinyl-glycinyl)spermidine BIS(gamma-glutamyl-cysteinyl-glycinyl)spermidine N1,N8-Bis(g-L-glutamyl-L-cysteinyl-glycyl)spermidine N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine N1,N8-Bis(glutathionyl)spermidine N1,N8-Bis-(g-L-glutamyl-L-cysteinyl-glycyl)-spermidine N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine N1,N8-Bis-(glutathionyl)spermidine Reduced trypanothione TSH Trypanothion trypanothione
kegg.compound:C02090 keggC:C02090	Trypanothione N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine N1,N8-Bis(glutathionyl)spermidine Reduced trypanothione
CHEBI:17842 chebi:17842	trypanothione (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 (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 N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine N1,N8-Bis(glutathionyl)spermidine N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine N1,N8-Bis-(glutathionyl)spermidine Reduced trypanothione TSH Trypanothion Trypanothione
metacyc.compound:TRYPANOTHIONE metacycM:TRYPANOTHIONE	trypanothione N1,N8-bis(glutathion-S-yl)spermidine N1,N8-bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine TSH
hmdb:HMDB60520 chebi:12620 chebi:12621 chebi:15034 chebi:15272 chebi:26528 chebi:27160 chebi:42644 chebi:9764 keggC:M_C02090 seedM:M_cpd01418	secondary/obsolete/fantasy identifier