EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:205278 - Nodulisporipyrone A

ChEBI IDCHEBI:205278
ChEBI NameNodulisporipyrone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20O4
Net Charge0
Average Mass240.299
Monoisotopic Mass240.13616
SMILESCCCCCC[C@@H](O)c1cc(OC)cc(=O)o1
InChIInChI=1S/C13H20O4/c1-3-4-5-6-7-11(14)12-8-10(16-2)9-13(15)17-12/h8-9,11,14H,3-7H2,1-2H3/t11-/m1/s1
InChIKeyPWEKKOYBULKAHZ-LLVKDONJSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies 65-12-7-1 (ncbitaxon:1380445) - PubMed (25981163)
ChEBI Ontology
Outgoing Relation(s)
Nodulisporipyrone A (CHEBI:205278) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
6-[(1R)-1-hydroxyheptyl]-4-methoxypyran-2-one
Manual XrefsDatabases
78437261ChemSpider