CHEBI:81486 - Sphondin

ChEBI IDCHEBI:81486
ChEBI NameSphondin
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC12H8O4
Net Charge0
Average Mass216.192
Monoisotopic Mass216.04226
SMILESCOc1cc2ccc(=O)oc2c2ccoc12
InChIInChI=1S/C12H8O4/c1-14-9-6-7-2-3-10(13)16-11(7)8-4-5-15-12(8)9/h2-6H,1H3
InChIKeyDLCJNIBLOSKIQW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Sphondin (CHEBI:81486) is a furanocoumarin (CHEBI:24128)
Manual XrefsDatabases
C18081KEGG COMPOUND
LSM-20961LINCS
Registry NumbersSources
CAS:483-66-9KEGG COMPOUND