CHEBI:79945 - 16alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one propionate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 16alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one propionate
ChEBI ID CHEBI:79945
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H31FO3
Net Charge 0
Average Mass 362.47810
Monoisotopic Mass 362.22572
InChI InChI=1S/C22H31FO3/c1-4-19(25)26-20-18(23)12-17-15-6-5-13-11-14(24)7-9-21(13,2)16(15)8-10-22(17,20)3/h11,15-18,20H,4-10,12H2,1-3H3/t15-,16+,17+,18-,20+,21+,22+/m1/s1
InChIKey AFBZBYQKIMBONK-ZELOLHMESA-N
SMILES CCC(=O)O[C@H]1[C@H](F)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing 16alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one propionate (CHEBI:79945) is a steroid ester (CHEBI:47880)
Synonym Source
16alpha-Fluorotestosterone propionate KEGG COMPOUND
Manual Xref Database
C15447 KEGG COMPOUND
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