CHEBI:80572 - Homotrypanothione

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ChEBI Name Homotrypanothione
ChEBI ID CHEBI:80572
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H51N9O10S2
Net Charge 0
Average Mass 737.88900
Monoisotopic Mass 737.32003
InChI InChI=1S/C28H51N9O10S2/c29-17(27(44)45)5-7-21(38)36-19(15-48)25(42)34-13-23(40)32-11-3-1-2-9-31-10-4-12-33-24(41)14-35-26(43)20(16-49)37-22(39)8-6-18(30)28(46)47/h17-20,31,48-49H,1-16,29-30H2,(H,32,40)(H,33,41)(H,34,42)(H,35,43)(H,36,38)(H,37,39)(H,44,45)(H,46,47)/t17-,18-,19-,20-/m0/s1
InChIKey XMVRDWGUVWNOBX-MUGJNUQGSA-N
SMILES N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)NCCCCCNCCCNC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Homotrypanothione (CHEBI:80572) is a peptide (CHEBI:16670)
Synonym Source
N1,N9-Bis(glutathionyl)aminopropylcadaverine KEGG COMPOUND
Manual Xref Database
C16567 KEGG COMPOUND
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