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CHEBI:218139 - Pyrenocine K

ChEBI IDCHEBI:218139
ChEBI NamePyrenocine K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O5
Net Charge0
Average Mass238.239
Monoisotopic Mass238.08412
SMILESCOc1cc(=O)oc2c1CO[C@@H](CC(C)=O)C2
InChIInChI=1S/C12H14O5/c1-7(13)3-8-4-11-9(6-16-8)10(15-2)5-12(14)17-11/h5,8H,3-4,6H2,1-2H3/t8-/m0/s1
InChIKeyGUGDAUYYWAEZBO-QMMMGPOBSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies (ncbitaxon:1715245) - PubMed (22233864)
ChEBI Ontology
Outgoing Relation(s)
Pyrenocine K (CHEBI:218139) is a pyranone (CHEBI:37963)
IUPAC Name 
(7R)-4-methoxy-7-(2-oxopropyl)-7,8-dihydro-5H-pyrano[4,3-b]pyran-2-one
Manual XrefsDatabases
31116303ChemSpider