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CHEBI:34163 - 16-Dehydropregnenolone acetate

ChEBI IDCHEBI:34163
ChEBI Name16-Dehydropregnenolone acetate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC23H32O3
Net Charge0
Average Mass356.506
Monoisotopic Mass356.23514
SMILES[H][C@@]12CC=C3C[C@@H](OC(C)=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(C(C)=O)=CC[C@@]21[H]
InChIInChI=1S/C23H32O3/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/h5,7,17-18,20-21H,6,8-13H2,1-4H3/t17-,18-,20-,21-,22-,23+/m0/s1
InChIKeyMZWRIOUCMXPLKV-RFOVXIPZSA-N
ChEBI Ontology
Outgoing Relation(s)
16-Dehydropregnenolone acetate (CHEBI:34163) is a steroid ester (CHEBI:47880)
Synonyms  Source
16-Dehydropregnenolone acetateKEGG COMPOUND
3beta-Acetyloxy-pregna-5,16-dien-20-oneKEGG COMPOUND
Manual XrefsDatabases
C14503KEGG COMPOUND
Registry NumbersSources
CAS:979-02-2KEGG COMPOUND