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CHEBI:79645 - 6alpha-Fluoropregn-4-ene-3,20-dione

Default Structure
ChEBI IDCHEBI:79645
ChEBI Name6alpha-Fluoropregn-4-ene-3,20-dione
Stars
DownloadsMolfile
FormulaC21H29FO2
Net Charge0
Average Mass332.459
Monoisotopic Mass332.21516
SMILES[H][C@@]12C[C@H](F)C3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](C(C)=O)CC[C@@]21[H]
InChIInChI=1S/C21H29FO2/c1-12(23)15-4-5-16-14-11-19(22)18-10-13(24)6-8-21(18,3)17(14)7-9-20(15,16)2/h10,14-17,19H,4-9,11H2,1-3H3/t14-,15+,16-,17-,19-,20+,21+/m0/s1
InChIKeyUZROOFLUFHWOJQ-ADDDSGAWSA-N
Roles Classification
Biological Role:
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.
ChEBI Ontology
Outgoing Relation(s)
6alpha-Fluoropregn-4-ene-3,20-dione (CHEBI:79645) is a corticosteroid hormone (CHEBI:36699)
Synonym  Source
6alpha-FluoroprogesteroneKEGG COMPOUND
Manual XrefsDatabases
C15127KEGG COMPOUND
Registry NumbersSources
CAS:2300-03-0KEGG COMPOUND