CHEBI:68286 - microdiplactone

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ChEBI Name microdiplactone
ChEBI ID CHEBI:68286
Definition An oxazinane that is 1,4-oxazepane substituted by propyl groups at positions 3 and 4 and an oxo group at position 7. It is isolated from the endophytic fungus Microdiplodia species.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C11H21NO2
Net Charge 0
Average Mass 199.28990
Monoisotopic Mass 199.15723
InChI InChI=1S/C11H21NO2/c1-3-5-10-9-14-11(13)6-8-12(10)7-4-2/h10H,3-9H2,1-2H3
InChIKey RAKAYJBOINMECV-UHFFFAOYSA-N
SMILES CCCC1COC(=O)CCN1CCC
Metabolite of Species Details
Microdiplodia (NCBI:txid371130) EtOAc extract of an endophytic fungi isolated from Lycium intricatum of strain 9907 See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing microdiplactone (CHEBI:68286) has role metabolite (CHEBI:25212)
microdiplactone (CHEBI:68286) is a ε-lactone (CHEBI:50239)
IUPAC Name
3,4-dipropyl-1,4-oxazepan-7-one
Registry Number Type Source
21389525 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21244021 PubMed citation Europe PMC
Last Modified
19 May 2014
General Comment
2013-08-21 The absolute sterochemistry has not been determined.