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CHEBI:226877 - Violaceoid F

ChEBI IDCHEBI:226877
ChEBI NameViolaceoid F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O4
Net Charge0
Average Mass252.310
Monoisotopic Mass252.13616
SMILESCCCCCC=CC1=C(CO)C(=O)[C@H]2O[C@H]2[C@@H]1O
InChIInChI=1S/C14H20O4/c1-2-3-4-5-6-7-9-10(8-15)12(17)14-13(18-14)11(9)16/h6-7,11,13-16H,2-5,8H2,1H3/t11-,13+,14-/m1/s1
InChIKeyGTZSDAILXWXHGN-KWCYVHTRSA-N
Species of MetaboliteComponentSourceComments
Aspergillus violaceofuscus (ncbitaxon:657443) - PubMed (24786915)
ChEBI Ontology
Outgoing Relation(s)
Violaceoid F (CHEBI:226877) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(1S,5R,6S)-4-hept-1-enyl-5-hydroxy-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one