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CHEBI:180779 - 6-beta-hydroxydexamethasone

ChEBI IDCHEBI:180779
ChEBI Name6-beta-hydroxydexamethasone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H29FO6
Net Charge0
Average Mass408.466
Monoisotopic Mass408.19482
SMILESC[C@@H]1CC2C3C[C@@H](O)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
InChIInChI=1S/C22H29FO6/c1-11-6-13-14-8-16(26)15-7-12(25)4-5-19(15,2)21(14,23)17(27)9-20(13,3)22(11,29)18(28)10-24/h4-5,7,11,13-14,16-17,24,26-27,29H,6,8-10H2,1-3H3/t11-,13?,14?,16-,17+,19+,20+,21+,22+/m1/s1
InChIKeyRVBSTEHLLHXILB-NFERVAMVSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) Article
ChEBI Ontology
Outgoing Relation(s)
6-beta-hydroxydexamethasone (CHEBI:180779) is a 21-hydroxy steroid (CHEBI:35344)
IUPAC Name 
(6R,9R,10S,11S,13S,16R,17R)-9-luoro-6,11,17-trihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Manual XrefsDatabases
HMDB0061022HMDB
59662747ChemSpider