CHEBI:33995 - (1R)-Hydroxy-(2R)-glutathionyl-1,2-dihydronaphthalene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (1R)-Hydroxy-(2R)-glutathionyl-1,2-dihydronaphthalene
ChEBI ID CHEBI:33995
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H25N3O7S
Net Charge 0
Average Mass 451.495
Monoisotopic Mass 451.14132
InChI InChI=1S/C20H25N3O7S/c21-13(20(29)30)6-8-16(24)23-14(19(28)22-9-17(25)26)10-31-15-7-5-11-3-1-2-4-12(11)18(15)27/h1-5,7,13-15,18,27H,6,8-10,21H2,(H,22,28)(H,23,24)(H,25,26)(H,29,30)/t13-,14-,15+,18+/m0/s1
InChIKey HBBDHJOSZGOTBV-OIPACUDHSA-N
SMILES N[C@@H](CCC(=O)N[C@@H](CS[C@@H]1C=Cc2ccccc2[C@H]1O)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 (1R)-Hydroxy-(2R)-glutathionyl-1,2-dihydronaphthalene (CHEBI:33995) is a peptide (CHEBI:16670)
Synonym Source
(1R)-Hydroxy-(2R)-glutathionyl-1,2-dihydronaphthalene KEGG COMPOUND
Manual Xref Database
C14791 KEGG COMPOUND
View more database links
Last Modified
27 January 2016