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CHEBI:196948 - 16-hydroxyprednisolone

ChEBI IDCHEBI:196948
ChEBI Name16-hydroxyprednisolone
Stars
DefinitionA 16-hydroxy steroid that is prednisolone carrying a hydroxy group at the 16 position.
Last Modified31 August 2023
Submittermwilliams
DownloadsMolfile
FormulaC21H28O6
Net Charge0
Average Mass376.449
Monoisotopic Mass376.18859
SMILES[H][C@@]12CC(O)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C21H28O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-7,13-16,18,22,24-25,27H,3-4,8-10H2,1-2H3/t13-,14-,15-,16?,18+,19-,20-,21-/m0/s1
InChIKeySEKYBDYVXDAYPY-OMBYMLGMSA-N
ChEBI Ontology
Outgoing Relation(s)
16-hydroxyprednisolone (CHEBI:196948) has functional parent prednisolone (CHEBI:8378)
16-hydroxyprednisolone (CHEBI:196948) is a 11β-hydroxy steroid (CHEBI:35346)
16-hydroxyprednisolone (CHEBI:196948) is a 16-hydroxy steroid (CHEBI:36840)
16-hydroxyprednisolone (CHEBI:196948) is a 17α-hydroxy steroid (CHEBI:35342)
16-hydroxyprednisolone (CHEBI:196948) is a 20-oxo steroid (CHEBI:36885)
16-hydroxyprednisolone (CHEBI:196948) is a 21-hydroxy steroid (CHEBI:35344)
16-hydroxyprednisolone (CHEBI:196948) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
16-hydroxyprednisolone (CHEBI:196948) is a C21-steroid (CHEBI:61313)
16-hydroxyprednisolone (CHEBI:196948) is a primary α-hydroxy ketone (CHEBI:139590)
16-hydroxyprednisolone (CHEBI:196948) is a tertiary α-hydroxy ketone (CHEBI:139592)
Incoming Relation(s)
16α-hydroxyprednisolone (CHEBI:173261) is a 16-hydroxyprednisolone (CHEBI:196948)
IUPAC Name 
11β,16,17,21-tetrahydroxypregna-1,4-diene-3,20-dione
Citations