EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:211223 - Rubasperone F

ChEBI IDCHEBI:211223
ChEBI NameRubasperone F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H28O11
Net Charge0
Average Mass588.565
Monoisotopic Mass588.16316
SMILESCOc1cc(OC)c2c(O)c3c(=O)cc(C)oc3c(-c3c(OC)cc(OC)c4c(O)c5c(cc34)OC(C)(O)CC5=O)c2c1
InChIInChI=1S/C32H28O11/c1-13-7-17(33)28-30(36)24-15(8-14(38-3)9-19(24)39-4)26(31(28)42-13)23-16-10-22-27(18(34)12-32(2,37)43-22)29(35)25(16)21(41-6)11-20(23)40-5/h7-11,35-37H,12H2,1-6H3
InChIKeyWZCGGWCDSQBTRM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1002/hlca.201100050)
ChEBI Ontology
Outgoing Relation(s)
Rubasperone F (CHEBI:211223) is a organic heterotricyclic compound (CHEBI:26979)
Rubasperone F (CHEBI:211223) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
10-(2,5-dihydroxy-6,8-dimethoxy-2-methyl-4-oxo-3H-benzo[g]chromen-9-yl)-5-hydroxy-6,8-dimethoxy-2-methylbenzo[g]chromen-4-one
Manual XrefsDatabases
29214333ChemSpider