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CHEBI:79478 - 17-Methylandrosta-4,6-diene-3beta,17beta-diol 3-acetate

ChEBI IDCHEBI:79478
ChEBI Name17-Methylandrosta-4,6-diene-3beta,17beta-diol 3-acetate
Stars
DownloadsMolfile
FormulaC22H32O3
Net Charge0
Average Mass344.495
Monoisotopic Mass344.23514
SMILES[H][C@@]12C=CC3=C[C@@H](OC(C)=O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1(C)O
InChIInChI=1S/C22H32O3/c1-14(23)25-16-7-10-20(2)15(13-16)5-6-17-18(20)8-11-21(3)19(17)9-12-22(21,4)24/h5-6,13,16-19,24H,7-12H2,1-4H3/t16-,17+,18-,19-,20-,21-,22-/m0/s1
InChIKeyCGBFTMGKAPXWPF-YRCTWBNTSA-N
ChEBI Ontology
Outgoing Relation(s)
17-Methylandrosta-4,6-diene-3beta,17beta-diol 3-acetate (CHEBI:79478) is a steroid ester (CHEBI:47880)
Manual XrefsDatabases
C14954KEGG COMPOUND