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CHEBI:79836 - 17beta-Hydroxy-4,4-dimethylandrost-5-en-3-one

ChEBI IDCHEBI:79836
ChEBI Name17beta-Hydroxy-4,4-dimethylandrost-5-en-3-one
Stars
Last Modified3 May 2017
DownloadsMolfile
FormulaC21H32O2
Net Charge0
Average Mass316.485
Monoisotopic Mass316.24023
SMILES[H][C@@]12CC=C3C(C)(C)C(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C21H32O2/c1-19(2)16-7-5-13-14-6-8-18(23)21(14,4)11-9-15(13)20(16,3)12-10-17(19)22/h7,13-15,18,23H,5-6,8-12H2,1-4H3/t13-,14-,15-,18-,20+,21-/m0/s1
InChIKeyYTYDBCHHXXGVEN-KUJXMBTLSA-N
ChEBI Ontology
Outgoing Relation(s)
17beta-Hydroxy-4,4-dimethylandrost-5-en-3-one (CHEBI:79836) is a 3-oxo-Δ5-steroid (CHEBI:47907)
Manual XrefsDatabases
C15334KEGG COMPOUND