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CHEBI:219299 - Pestaxanthone

ChEBI IDCHEBI:219299
ChEBI NamePestaxanthone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILESCc1cc(CO)c2c(=O)c3c(O)c(C[C@H](O)C(C)(C)O)ccc3oc2c1
InChIInChI=1S/C20H22O6/c1-10-6-12(9-21)16-14(7-10)26-13-5-4-11(8-15(22)20(2,3)25)18(23)17(13)19(16)24/h4-7,15,21-23,25H,8-9H2,1-3H3/t15-/m0/s1
InChIKeyHMOJWLADOJJVCE-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Neopestalotiopsis clavispora (ncbitaxon:289240) - DOI (10.1016/j.tetlet.2016.03.101)
ChEBI Ontology
Outgoing Relation(s)
Pestaxanthone (CHEBI:219299) is a xanthones (CHEBI:51149)
IUPAC Name 
2-(2,3-dihydroxy-3-methylbutyl)-1-hydroxy-8-(hydroxymethyl)-6-methylxanthen-9-one
Manual XrefsDatabases
58196704ChemSpider