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Concept information

... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 20-oxo steroid > 9-fluoro-11beta-hydroxypregna-4,16-diene-3,20-dione

Preferred term

9-fluoro-11beta-hydroxypregna-4,16-diene-3,20-dione  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C21H27FO3

inchi

  • InChI=1S/C21H27FO3/c1-12(23)15-6-7-16-17-5-4-13-10-14(24)8-9-20(13,3)21(17,22)18(25)11-19(15,16)2/h6,10,16-18,25H,4-5,7-9,11H2,1-3H3/t16-,17-,18-,19+,20-,21-/m0/s1

inchikey

  • WHFHAAOGZDECTE-OLGWUGKESA-N

mass

  • 346.43570

monoisotopicmass

  • 346.19442

smiles

  • CC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79598

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