EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:197821 - Lecanorafuran B

Default Structure
ChEBI IDCHEBI:197821
ChEBI NameLecanorafuran B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H22O6
Net Charge0
Average Mass454.478
Monoisotopic Mass454.14164
SMILESCc1cc(O)cc2oc3cc(O)c(-c4c(O)cc(C)c5c4oc4cc(O)cc(C)c45)c(C)c3c12
InChIInChI=1S/C28H22O6/c1-11-5-16(30)9-20-22(11)24-13(3)7-17(31)27(28(24)34-20)25-14(4)26-21(10-18(25)32)33-19-8-15(29)6-12(2)23(19)26/h5-10,29-32H,1-4H3
InChIKeyILWJTNFKUKCEBT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Lecanorafuran B (CHEBI:197821) is a dibenzofurans (CHEBI:38922)
IUPAC Name 
2-(3,7-dihydroxy-1,9-dimethyldibenzouran-4-yl)-1,9-dimethyldibenzouran-3,7-diol
Manual XrefsDatabases
10193262ChemSpider