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CHEBI:200947 - (+/-)-asperlone B

ChEBI IDCHEBI:200947
ChEBI Name(+/-)-asperlone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H12O8
Net Charge0
Average Mass380.308
Monoisotopic Mass380.05322
SMILESO=C1C2=C3C(=CC(=O)c4c(O)cc(O)cc43)O[C@@]2(O)Cc2cc(O)cc(O)c21
InChIInChI=1S/C20H12O8/c21-8-1-7-6-20(27)18(19(26)15(7)11(23)3-8)17-10-2-9(22)4-12(24)16(10)13(25)5-14(17)28-20/h1-5,21-24,27H,6H2/t20-/m0/s1
InChIKeyPQMCIVKFVIEIHQ-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies 16-5C (ncbitaxon:1284283) - PubMed (25591039)
ChEBI Ontology
Outgoing Relation(s)
(+/-)-asperlone B (CHEBI:200947) is a naphthofuran (CHEBI:39270)
IUPAC Name 
5,7,13,17,19-pentahydroxy-12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1,3(8),4,6,10,15(20),16,18-octaene-9,21-dione
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35516722ChemSpider