CHEBI:34228 - 2,3-Dihydro-2-S-glutathionyl-3-hydroxy bromobenzene

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ChEBI Name 2,3-Dihydro-2-S-glutathionyl-3-hydroxy bromobenzene
ChEBI ID CHEBI:34228
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H22BrN3O7S
Net Charge 0
Average Mass 480.332
Monoisotopic Mass 479.03618
InChI InChI=1S/C16H22BrN3O7S/c17-8-2-1-3-11(21)14(8)28-7-10(15(25)19-6-13(23)24)20-12(22)5-4-9(18)16(26)27/h1-3,9-11,14,21H,4-7,18H2,(H,19,25)(H,20,22)(H,23,24)(H,26,27)/t9-,10-,11?,14?/m0/s1
InChIKey BYHFLDCNLZPMDY-PXAOEZFJSA-N
SMILES N[C@@H](CCC(=O)N[C@@H](CSC1C(O)C=CC=C1Br)C(=O)NCC(O)=O)C(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
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 2,3-Dihydro-2-S-glutathionyl-3-hydroxy bromobenzene (CHEBI:34228) is a peptide (CHEBI:16670)
Synonym Source
2,3-Dihydro-2-S-glutathionyl-3-hydroxy bromobenzene KEGG COMPOUND
Manual Xrefs Databases
C14848 KEGG COMPOUND
HMDB0060358 HMDB
View more database links
Last Modified
27 January 2016