EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:2183 - 6-Deoxyjacareubin

ChEBI IDCHEBI:2183
ChEBI Name6-Deoxyjacareubin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC18H14O5
Net Charge0
Average Mass310.305
Monoisotopic Mass310.08412
SMILESCC1(C)C=Cc2c(cc3oc4c(O)cccc4c(=O)c3c2O)O1
InChIInChI=1S/C18H14O5/c1-18(2)7-6-9-12(23-18)8-13-14(15(9)20)16(21)10-4-3-5-11(19)17(10)22-13/h3-8,19-20H,1-2H3
InChIKeyNHNIESSJWQBRJW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-Deoxyjacareubin (CHEBI:2183) is a pyranoxanthones (CHEBI:71238)
Synonym  Source
6-DeoxyjacareubinKEGG COMPOUND
Manual XrefsDatabases
C10059KEGG COMPOUND
C00002947KNApSAcK
Registry NumbersSources
CAS:16265-56-8KEGG COMPOUND