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CHEBI:218030 - 12-O-acetyl-AGI-B4

ChEBI IDCHEBI:218030
ChEBI Name12-O-acetyl-AGI-B4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H16O8
Net Charge0
Average Mass360.318
Monoisotopic Mass360.08452
SMILESCOC(=O)[C@@H]1c2c(oc3cc(COC(C)=O)cc(O)c3c2=O)C=C[C@H]1O
InChIInChI=1S/C18H16O8/c1-8(19)25-7-9-5-11(21)14-13(6-9)26-12-4-3-10(20)15(18(23)24-2)16(12)17(14)22/h3-6,10,15,20-21H,7H2,1-2H3/t10-,15+/m1/s1
InChIKeyCUPACTPQNJJKNP-BMIGLBTASA-N
Species of MetaboliteComponentSourceComments
Scopulariopsisspecies (ncbitaxon:2006378) - DOI (10.1016/j.tet.2016.03.073)
ChEBI Ontology
Outgoing Relation(s)
12-O-acetyl-AGI-B4 (CHEBI:218030) is a xanthones (CHEBI:51149)
IUPAC Name 
methyl (1R,2R)-6-(acetyloxymethyl)-2,8-dihydroxy-9-oxo-1,2-dihydroxanthene-1-carboxylate
Manual XrefsDatabases
58196694ChemSpider