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CHEBI:198217 - Photinide A

ChEBI IDCHEBI:198217
ChEBI NamePhotinide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESCOc1cccc2c1C(=O)/C(=C(\CO)[C@@H]1OC(=O)C[C@H]1C)O2
InChIInChI=1S/C16H16O6/c1-8-6-12(18)22-15(8)9(7-17)16-14(19)13-10(20-2)4-3-5-11(13)21-16/h3-5,8,15,17H,6-7H2,1-2H3/b16-9-/t8-,15-/m1/s1
InChIKeyMZQDVARUQLLSGL-DAASKRTBSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis photiniae (ncbitaxon:289238) - PubMed (19371070)
ChEBI Ontology
Outgoing Relation(s)
Photinide A (CHEBI:198217) is a benzofurans (CHEBI:35259)
IUPAC Name 
(2Z)-2-[2-hydroxy-1-[(2R,3R)-3-methyl-5-oxooxolan-2-yl]ethylidene]-4-methoxy-1-benzouran-3-one
Manual XrefsDatabases
24622871ChemSpider