CHEBI:34101 - 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene

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ChEBI Name 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene
ChEBI ID CHEBI:34101
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H24N4O9S
Net Charge 0
Average Mass 496.493
Monoisotopic Mass 496.12640
InChI InChI=1S/C20H24N4O9S/c21-12(20(30)31)5-7-16(25)23-13(19(29)22-8-17(26)27)9-34-15-6-4-10-11(18(15)28)2-1-3-14(10)24(32)33/h1-4,6,12-13,15,18,28H,5,7-9,21H2,(H,22,29)(H,23,25)(H,26,27)(H,30,31)/t12-,13-,15?,18?/m0/s1
InChIKey SFJZEQDXMXSLGC-RJXQQRCHSA-N
SMILES N[C@@H](CCC(=O)N[C@@H](CSC1C=Cc2c(cccc2[N+]([O-])=O)C1O)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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene (CHEBI:34101) is a peptide (CHEBI:16670)
Synonym Source
1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene KEGG COMPOUND
Manual Xrefs Databases
C14805 KEGG COMPOUND
HMDB0060327 HMDB
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Last Modified
27 January 2016