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CHEBI:83024 - glucosyl-6β-hydroxytestosterone

ChEBI IDCHEBI:83024
ChEBI Nameglucosyl-6β-hydroxytestosterone
Stars
ASCII Nameglucosyl-6beta-hydroxytestosterone
DefinitionA steroid saponin that is 6β-hydroxytestosterone attached to a α-D-glucopyranosyl residue at position 6 via glycosidic linkage.
Last Modified24 September 2014
DownloadsMolfile
FormulaC25H38O8
Net Charge0
Average Mass466.571
Monoisotopic Mass466.25667
SMILES[H][C@@]12C[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C25H38O8/c1-24-7-5-12(27)9-16(24)17(32-23-22(31)21(30)20(29)18(11-26)33-23)10-13-14-3-4-19(28)25(14,2)8-6-15(13)24/h9,13-15,17-23,26,28-31H,3-8,10-11H2,1-2H3/t13-,14-,15-,17+,18+,19-,20+,21-,22+,23-,24+,25-/m0/s1
InChIKeyCZISKGRAMZYTOO-LXDCVNORSA-N
Species of MetaboliteComponentSourceComments
Daphnia magna (ncbitaxon:35525) - Article (Changes in the Metabolic Elimination Profile of Testosterone Following Exposure of the Crustacean Daphnia magna to TributyltinGerald A. LeBlanc and James B. McLachlanEcotoxicology and Environmental Safety 45, 296-303 (2000))
Roles Classification
Biological Roles:
Daphnia magna metabolite  A Daphnia metabolite produced by the species Daphnia magna.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) has functional parent 6β-hydroxytestosterone (CHEBI:34477)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) has role Daphnia magna metabolite (CHEBI:83056)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) is a 17β-hydroxy steroid (CHEBI:35343)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) is a 3-oxo-Δ4 steroid (CHEBI:47909)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) is a monosaccharide derivative (CHEBI:63367)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) is a steroid saponin (CHEBI:61655)
glucosyl-6β-hydroxytestosterone (CHEBI:83024) is a α-D-glucoside (CHEBI:22390)
IUPAC Name 
(6β)-17β-hydroxy-3-oxoandrost-4-en-6-yl α-D-glucopyranoside