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CHEBI:34003 - 9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol

ChEBI IDCHEBI:34003
ChEBI Name9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol
Stars
ASCII Name9-fluoro-17-methyl-5beta-androstane-3alpha,11beta,17beta-triol
Last Modified29 January 2014
DownloadsMolfile
FormulaC20H33FO3
Net Charge0
Average Mass340.479
Monoisotopic Mass340.24137
SMILES[H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@](C)(O)[C@@]4(C)C[C@H](O)[C@]3(F)[C@@]1(C)CC[C@@H](O)C2
InChIInChI=1S/C20H33FO3/c1-17-8-6-13(22)10-12(17)4-5-15-14-7-9-19(3,24)18(14,2)11-16(23)20(15,17)21/h12-16,22-24H,4-11H2,1-3H3/t12-,13-,14+,15+,16+,17+,18+,19+,20+/m1/s1
InChIKeyXKASGEXHNLDQIB-ZPPBZJDISA-N
ChEBI Ontology
Outgoing Relation(s)
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol (CHEBI:34003) is a 11β-hydroxy steroid (CHEBI:35346)
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol (CHEBI:34003) is a 17β-hydroxy steroid (CHEBI:35343)
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol (CHEBI:34003) is a 3α-hydroxy steroid (CHEBI:36835)
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol (CHEBI:34003) is a androstanoid (CHEBI:50402)
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol (CHEBI:34003) is a fluorinated steroid (CHEBI:50830)
IUPAC Name 
9-fluoro-17-methyl-5β-androstane-3α,11β,17β-triol
Synonyms  Source
(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triolKEGG COMPOUND
9alpha-Fluoro-17alpha-methyl-5beta-androstane-3alpha,11beta,17-triolKEGG COMPOUND
Manual XrefsDatabases
C14616KEGG COMPOUND
Registry NumbersSources
CAS:53649-14-2KEGG COMPOUND
CAS:53649-14-2ChemIDplus