CHEBI:34517 - 9alpha-Fluoro-11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate

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ChEBI Name 9alpha-Fluoro-11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate
ChEBI ID CHEBI:34517
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H29FO6
Net Charge 0
Average Mass 420.472
Monoisotopic Mass 420.19482
InChI InChI=1S/C23H29FO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h6,8,10,16-18,27,29H,4-5,7,9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1
InChIKey ZOCUOMKMBMEYQV-GSLJADNHSA-N
SMILES CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
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ChEBI Ontology
Outgoing 9alpha-Fluoro-11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate (CHEBI:34517) is a corticosteroid hormone (CHEBI:36699)
Synonyms Sources
9-fluoroprednisolone acetate DrugCentral
9alpha-Fluoro-11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate KEGG COMPOUND
deltarhinol DrugCentral
Isoflupredone acetate KEGG COMPOUND
U-6013 KEGG COMPOUND
Manual Xrefs Databases
4962 DrugCentral
C14636 KEGG COMPOUND
D04627 KEGG DRUG
View more database links
Registry Number Type Source
338-98-7 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017