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CHEBI:200994 - Preubetaochromone B

ChEBI IDCHEBI:200994
ChEBI NamePreubetaochromone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O7
Net Charge0
Average Mass320.297
Monoisotopic Mass320.08960
SMILESCOC(=O)[C@H]1c2c(oc3cccc(O)c3c2=O)C[C@](C)(O)[C@H]1O
InChIInChI=1S/C16H16O7/c1-16(21)6-9-11(12(14(16)19)15(20)22-2)13(18)10-7(17)4-3-5-8(10)23-9/h3-5,12,14,17,19,21H,6H2,1-2H3/t12-,14-,16-/m0/s1
InChIKeySNONMTWEUGSZCO-NOLJZWGESA-N
Species of MetaboliteComponentSourceComments
Preussia africana (ncbitaxon:269684) - PubMed (22324636)
ChEBI Ontology
Outgoing Relation(s)
Preubetaochromone B (CHEBI:200994) is a xanthones (CHEBI:51149)
IUPAC Name 
methyl (1S,2S,3S)-2,3,8-trihydroxy-3-methyl-9-oxo-2,4-dihydro-1H-xanthene-1-carboxylate
Manual XrefsDatabases
28524789ChemSpider