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CHEBI:79918 - 3beta-Hydroxy-5alpha-pregnan-20-one acetate

ChEBI IDCHEBI:79918
ChEBI Name3beta-Hydroxy-5alpha-pregnan-20-one acetate
Stars
DownloadsMolfile
FormulaC23H36O3
Net Charge0
Average Mass360.538
Monoisotopic Mass360.26645
SMILES[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](C(C)=O)CC[C@@]34[H])[C@@]1(C)CC[C@H](OC(C)=O)C2
InChIInChI=1S/C23H36O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h16-21H,5-13H2,1-4H3/t16-,17-,18-,19+,20-,21-,22-,23+/m0/s1
InChIKeyGFHOQCXDABGYAL-POBGKJHXSA-N
ChEBI Ontology
Outgoing Relation(s)
3beta-Hydroxy-5alpha-pregnan-20-one acetate (CHEBI:79918) is a steroid ester (CHEBI:47880)
Synonym  Source
3beta-Acetoxy-5alpha-pregnan-20-oneKEGG COMPOUND
Manual XrefsDatabases
C15417KEGG COMPOUND