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CHEBI:32709 - 6-dehydrotestosterone 17-glucosiduronic acid

ChEBI IDCHEBI:32709
ChEBI Name6-dehydrotestosterone 17-glucosiduronic acid
Stars
Last Modified22 December 2006
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC25H34O8
Net Charge0
Average Mass462.539
Monoisotopic Mass462.22537
SMILES[H][C@@]12C=CC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]21[H]
InChIInChI=1S/C25H34O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h3-4,11,14-21,23,27-29H,5-10H2,1-2H3,(H,30,31)/t14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1
InChIKeyGCIVSXAHMONYLO-HMAFJQTKSA-N
ChEBI Ontology
Outgoing Relation(s)
6-dehydrotestosterone 17-glucosiduronic acid (CHEBI:32709) has functional parent 6-dehydrotestosterone (CHEBI:29117)
6-dehydrotestosterone 17-glucosiduronic acid (CHEBI:32709) is a steroid glucosiduronic acid (CHEBI:26763)
IUPAC Name 
3-oxoandrosta-4,6-dien-17β-yl β-D-glucopyranosiduronic acid
Synonyms  Source
6,7-didehydrotestosterone O-glucuronideChEBI
6-dehydrotestosterone O-glucuronideChEBI