EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:225853 - Pyranterrone C

ChEBI IDCHEBI:225853
ChEBI NamePyranterrone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H13NO4
Net Charge0
Average Mass259.261
Monoisotopic Mass259.08446
SMILESC=C1NC(=O)C2=C1C(O)=C(/C=C/CCC)C(=O)C2=O
InChIInChI=1S/C14H13NO4/c1-3-4-5-6-8-11(16)9-7(2)15-14(19)10(9)13(18)12(8)17/h5-6,16H,2-4H2,1H3,(H,15,19)/b6-5+
InChIKeyGVYSZPIOAWJVNR-AATRIKPKSA-N
Species of MetaboliteComponentSourceComments
Aspergillus terreus (ncbitaxon:33178) - PubMed (32077283)
ChEBI Ontology
Outgoing Relation(s)
Pyranterrone C (CHEBI:225853) is a isoindoles (CHEBI:24897)
IUPAC Name 
4-hydroxy-3-methylidene-5-[(E)-pent-1-enyl]isoindole-1,6,7-trione