EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:215919 - Asperetide

ChEBI IDCHEBI:215919
ChEBI NameAsperetide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O3
Net Charge0
Average Mass218.252
Monoisotopic Mass218.09429
SMILESC=CCC[C@@H]1OC(=O)c2c(OC)cccc21
InChIInChI=1S/C13H14O3/c1-3-4-7-10-9-6-5-8-11(15-2)12(9)13(14)16-10/h3,5-6,8,10H,1,4,7H2,2H3/t10-/m0/s1
InChIKeyPZUFYUXNVZQDTO-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (30294975)
ChEBI Ontology
Outgoing Relation(s)
Asperetide (CHEBI:215919) is a benzofurans (CHEBI:35259)
IUPAC Name 
(3S)-3-but-3-enyl-7-methoxy-3H-2-benzouran-1-one