CHEBI:77008 - 1β-glutathionylseleno-N-acetyl-D-galactosamine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1β-glutathionylseleno-N-acetyl-D-galactosamine ChEBI ID CHEBI:77008 ChEBI ASCII Name 1beta-glutathionylseleno-N-acetyl-D-galactosamine Definition A glutathione conjugate obtained by formation of a thioselenide link between the thiol group of glutathione and the selenol group of 1-seleno-N-acetyl-D-galactosamine. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H30N4O11SSe Net Charge 0 Average Mass 589.48000 Monoisotopic Mass 590.07970 InChI InChI=1S/C18H30N4O11SSe/c1-7(24)21-13-15(29)14(28)10(5-23)33-18(13)35-34-6-9(16(30)20-4-12(26)27)22-11(25)3-2-8(19)17(31)32/h8-10,13-15,18,23,28-29H,2-6,19H2,1H3,(H,20,30)(H,21,24)(H,22,25)(H,26,27)(H,31,32)/t8-,9-,10+,13+,14-,15+,18-/m0/s1 InChIKey HQOJMKFQHAKPHO-YOHQSKSESA-N SMILES CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1[Se]SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O Roles Classification Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. View more via ChEBI Ontology ChEBI Ontology Outgoing 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) has functional parent N-acetyl-β-D-galactosamine (CHEBI:28497) 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) has role human xenobiotic metabolite (CHEBI:76967) 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) is a glutathione conjugate (CHEBI:24335) 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) is a monosaccharide derivative (CHEBI:63367) 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) is a organoselenium compound (CHEBI:25712) 1β-glutathionylseleno-N-acetyl-D-galactosamine (CHEBI:77008) is a thioselenide (CHEBI:64726) IUPAC Name (2S)-5-({(2R)-3-({[(2S,3R,4R,5R,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]selanyl}sulfanyl)-1-[(carboxymethyl)amino]-1-oxopropan-2-yl}amino)-2-amino-5-oxopentanoic acid Synonyms Sources GSSe-β-GalNAc ChEBI GSSebGalNac ChEBI selenosugar A ChEBI Citation Type Source 16600319 PubMed citation Europe PMC Last Modified 19 February 2014