CHEBI:88771 - 11-Oxo-androsterone glucuronide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 11-Oxo-androsterone glucuronide
ChEBI ID CHEBI:88771
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H36O9
Net Charge 0
Average Mass 480.549
Monoisotopic Mass 480.23593
InChI InChI=1S/C25H36O9/c1-24-8-7-12(33-23-20(30)18(28)19(29)21(34-23)22(31)32)9-11(24)3-4-13-14-5-6-16(27)25(14,2)10-15(26)17(13)24/h11-14,17-21,23,28-30H,3-10H2,1-2H3,(H,31,32)
InChIKey QTXWOOLAHRQMGZ-UHFFFAOYSA-N
SMILES O(C1CC2C(C3C(C4C(CC3=O)(C(=O)CC4)C)CC2)(CC1)C)C5OC(C(O)C(O)C5O)C(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
ChEBI Ontology
Outgoing 11-Oxo-androsterone glucuronide (CHEBI:88771) is a steroid glucosiduronic acid (CHEBI:26763)
Synonyms Sources
11-Oxo-etiocholanolone glucuronide HMDB
11-Oxoandrosterone glucuronide HMDB
11-Oxoetiocholanolone glucuronide HMDB
6-({2,15-dimethyl-14,17-dioxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid HMDB
Manual Xrefs Databases
Beta-D-Glucuronides MetaCyc
HMDB0010338 HMDB
View more database links
Citation Waiting for Citations Type Source
22624806 PubMed citation Europe PMC