CHEBI:196948 - 16-hydroxyprednisolone

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ChEBI Name 16-hydroxyprednisolone
ChEBI ID CHEBI:196948
Definition A 16-hydroxy steroid that is prednisolone carrying a hydroxy group at the 16 position.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information
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Formula C21H28O6
Net Charge 0
Average Mass 376.449
Monoisotopic Mass 376.18859
InChI InChI=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
InChIKey SEKYBDYVXDAYPY-OMBYMLGMSA-N
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@]12C
ChEBI Ontology
Outgoing 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-Δ14-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 16α-hydroxyprednisolone (CHEBI:173261) is a 16-hydroxyprednisolone (CHEBI:196948)
IUPAC Name
11β,16,17,21-tetrahydroxypregna-1,4-diene-3,20-dione
Citation Waiting for Citations Type Source
16435573 PubMed citation Europe PMC
Last Modified
31 August 2023