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CHEBI:79588 - 17beta-Hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate

ChEBI IDCHEBI:79588
ChEBI Name17beta-Hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate
Stars
DownloadsMolfile
FormulaC20H28O4
Net Charge0
Average Mass332.440
Monoisotopic Mass332.19876
SMILES[H][C@@]12CC[C@@]3([H])OC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](OC(C)=O)CC[C@@]21[H]
InChIInChI=1S/C20H28O4/c1-12(21)23-16-7-5-14-13-4-6-17-20(3,11-9-18(22)24-17)15(13)8-10-19(14,16)2/h9,11,13-17H,4-8,10H2,1-3H3/t13-,14-,15-,16-,17+,19-,20+/m0/s1
InChIKeyNJHXENDODLZLSB-SHUFMVBLSA-N
ChEBI Ontology
Outgoing Relation(s)
17beta-Hydroxy-4-oxa-5alpha-androst-1-en-3-one acetate (CHEBI:79588) is a oxo steroid (CHEBI:35789)
Manual XrefsDatabases
C15068KEGG COMPOUND