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CHEBI:198863 - Truncatone B

ChEBI IDCHEBI:198863
ChEBI NameTruncatone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H14O5
Net Charge0
Average Mass334.327
Monoisotopic Mass334.08412
SMILESO=C1C[C@@]2(O)C(=C3CCC(=O)c4c(O)ccc2c43)c2cccc(O)c21
InChIInChI=1S/C20H14O5/c21-12-3-1-2-9-17(12)15(24)8-20(25)11-5-7-14(23)18-13(22)6-4-10(16(11)18)19(9)20/h1-3,5,7,21,23,25H,4,6,8H2/t20-/m0/s1
InChIKeySKSDIVKAMYSIIU-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Annulohypoxylonspecies (ncbitaxon:1896106) - DOI (10.1016/j.tet.2016.08.054)
ChEBI Ontology
Outgoing Relation(s)
Truncatone B (CHEBI:198863) is a phenylpropanoid (CHEBI:26004)
IUPAC Name 
(11S)-7,11,15-trihydroxypentacyclo[10.7.1.02,11.03,8.016,20]icosa-1,3(8),4,6,12(20),13,15-heptaene-9,17-dione
Manual XrefsDatabases
78436415ChemSpider