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CHEBI:218164 - Pysarone A

ChEBI IDCHEBI:218164
ChEBI NamePysarone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O5
Net Charge0
Average Mass252.266
Monoisotopic Mass252.09977
SMILESCO[C@H]1C2=C(C(=O)O[C@@H](C)[C@H]2O)[C@H]2CCC(=O)[C@H]21
InChIInChI=1S/C13H16O5/c1-5-11(15)10-9(13(16)18-5)6-3-4-7(14)8(6)12(10)17-2/h5-6,8,11-12,15H,3-4H2,1-2H3/t5-,6-,8-,11+,12+/m0/s1
InChIKeyHHAQCJVEHVPEJC-JXCMNVCGSA-N
Species of MetaboliteComponentSourceComments
Fusarium (ncbitaxon:5506) - PubMed (30145336)
ChEBI Ontology
Outgoing Relation(s)
Pysarone A (CHEBI:218164) is a pyranone (CHEBI:37963)
IUPAC Name 
(3S,4S,5R,5aR,8aS)-4-hydroxy-5-methoxy-3-methyl-4,5,5a,7,8,8a-hexahydro-3H-pentaleno[1,2-c]pyran-1,6-dione