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CHEBI:222728 - Hispidulone A

ChEBI IDCHEBI:222728
ChEBI NameHispidulone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H12O6
Net Charge0
Average Mass276.244
Monoisotopic Mass276.06339
SMILESCOC1=CC(=O)c2c(C)cc(O)c3c2[C@@]1(O)COC3=O
InChIInChI=1S/C14H12O6/c1-6-3-7(15)11-12-10(6)8(16)4-9(19-2)14(12,18)5-20-13(11)17/h3-4,15,18H,5H2,1-2H3/t14-/m1/s1
InChIKeySMAURRJHZJPIDC-CQSZACIVSA-N
Species of MetaboliteComponentSourceComments
Chaetosphaeronema hispidulum (ncbitaxon:565418) - PubMed (31624336)
ChEBI Ontology
Outgoing Relation(s)
Hispidulone A (CHEBI:222728) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(5R)-5,12-dihydroxy-6-methoxy-10-methyl-3-oxatricyclo[7.3.1.05,13]trideca-1(12),6,9(13),10-tetraene-2,8-dione