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CHEBI:69775 - annuionone D

ChEBI IDCHEBI:69775
ChEBI Nameannuionone D
Stars
DefinitionA natural product found in Brachystemma calycinum.
Last Modified22 September 2014
DownloadsMolfile
FormulaC13H20O3
Net Charge0
Average Mass224.300
Monoisotopic Mass224.14124
SMILESCC(=O)/C=C/[C@]12O[C@@]1(C)C[C@@H](O)CC2(C)C
InChIInChI=1S/C13H20O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,10,15H,7-8H2,1-4H3/b6-5+/t10-,12-,13+/m0/s1
InChIKeyVYKLRWGPNUVKNC-HNSJSBKASA-N
Species of MetaboliteComponentSourceComments
Brachystemma calycinum (IPNI:151926-1) aerial part (BTO:0001658) PubMed (21634415) 95% aqueous ethanolic extract of sun-dreid and powdered aerial parts
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
annuionone D (CHEBI:69775) has role metabolite (CHEBI:25212)
annuionone D (CHEBI:69775) is a oxacycle (CHEBI:38104)
Synonym  Source
(3E)-4-[(1R,4S,6S)-4-Hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-3-buten-2-oneChEBI
Citations