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CHEBI:137491 - epitestosterone 17-O-(β-D-glucuronide)

ChEBI IDCHEBI:137491
ChEBI Nameepitestosterone 17-O-(β-D-glucuronide)
Stars
ASCII Nameepitestosterone 17-O-(beta-D-glucuronide)
DefinitionA steroid glucosiduronic acid that is epitestosterone in which the hydroxy hydrogen at position 17 has been replaced by a β-D-glucuronyl residue.
Last Modified21 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC25H36O8
Net Charge0
Average Mass464.555
Monoisotopic Mass464.24102
SMILES[H][C@@]12CCC3=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/C25H36O8/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/h11,14-21,23,27-29H,3-10H2,1-2H3,(H,30,31)/t14-,15-,16-,17+,18-,19-,20+,21-,23+,24-,25-/m0/s1
InChIKeyNIKZPECGCSUSBV-RWUBDERLSA-N
ChEBI Ontology
Outgoing Relation(s)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) has functional parent epitestosterone (CHEBI:42534)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) is a 3-oxo steroid (CHEBI:47788)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) is a enone (CHEBI:51689)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) is a steroid glucosiduronic acid (CHEBI:26763)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) is a β-D-glucosiduronic acid (CHEBI:15341)
epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491) is conjugate acid of epitestosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136673)
Incoming Relation(s)
epitestosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136673) is conjugate base of epitestosterone 17-O-(β-D-glucuronide) (CHEBI:137491)
IUPAC Name 
3-oxoandrost-4-en-17α-yl β-D-glucopyranosiduronic acid
Synonym  Source
17α-testosterone 17-O-(β-D-glucuronide)ChEBI
Citations