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CHEBI:216734 - JBIR-89

ChEBI IDCHEBI:216734
ChEBI NameJBIR-89
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O4
Net Charge0
Average Mass226.272
Monoisotopic Mass226.12051
SMILESCCCCC=CC1=C(C)[C@](O)(CO)OC1=O
InChIInChI=1S/C12H18O4/c1-3-4-5-6-7-10-9(2)12(15,8-13)16-11(10)14/h6-7,13,15H,3-5,8H2,1-2H3/t12-/m0/s1
InChIKeyNIJVXGHTKASCQE-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (20664606)
ChEBI Ontology
Outgoing Relation(s)
JBIR-89 (CHEBI:216734) is a butenolide (CHEBI:50523)
IUPAC Name 
3-hex-1-enyl-5-hydroxy-5-(hydroxymethyl)-4-methyluran-2-one