EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:203538 - Putaminoxin E

ChEBI IDCHEBI:203538
ChEBI NamePutaminoxin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O3
Net Charge0
Average Mass214.305
Monoisotopic Mass214.15689
SMILESCCCC1CCC[C@H](O)CCCC(=O)O1
InChIInChI=1S/C12H22O3/c1-2-5-11-8-3-6-10(13)7-4-9-12(14)15-11/h10-11,13H,2-9H2,1H3/t10-,11?/m0/s1
InChIKeyPPXGPMYYKWZILB-VUWPPUDQSA-N
Species of MetaboliteComponentSourceComments
Paraboeremia putaminum (ncbitaxon:1770246) - DOI (10.1016/s0031-9422(97)00879-0)
ChEBI Ontology
Outgoing Relation(s)
Putaminoxin E (CHEBI:203538) is a lactone (CHEBI:25000)
IUPAC Name 
(6S)-6-hydroxy-10-propyloxecan-2-one
Manual XrefsDatabases
8735981ChemSpider