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CHEBI:205968 - 13(b)-Acetoxy-anhydroisoheximide

ChEBI IDCHEBI:205968
ChEBI Name13(b)-Acetoxy-anhydroisoheximide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H23NO5
Net Charge0
Average Mass321.373
Monoisotopic Mass321.15762
SMILESCC(=O)O[C@]1(C)C/C(=C\CC2CC(=O)NC(=O)C2)C(=O)[C@H](C)C1
InChIInChI=1S/C17H23NO5/c1-10-8-17(3,23-11(2)19)9-13(16(10)22)5-4-12-6-14(20)18-15(21)7-12/h5,10,12H,4,6-9H2,1-3H3,(H,18,20,21)/b13-5+/t10-,17+/m1/s1
InChIKeyOYHDNVYRXVFVIC-XXXSNJEDSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31885279)
ChEBI Ontology
Outgoing Relation(s)
13(b)-Acetoxy-anhydroisoheximide (CHEBI:205968) is a tetrahydropyridine (CHEBI:26921)
IUPAC Name 
[(1S,3E,5R)-3-[2-(2,6-dioxopiperidin-4-yl)ethylidene]-1,5-dimethyl-4-oxocyclohexyl] acetate