EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:198867 - (+)-applanatumol X

ChEBI IDCHEBI:198867
ChEBI Name(+)-applanatumol X
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12O5
Net Charge0
Average Mass248.234
Monoisotopic Mass248.06847
SMILESO=C1c2cc(O)ccc2O[C@H]2CC[C@H](C(=O)O)[C@@H]12
InChIInChI=1S/C13H12O5/c14-6-1-3-9-8(5-6)12(15)11-7(13(16)17)2-4-10(11)18-9/h1,3,5,7,10-11,14H,2,4H2,(H,16,17)/t7-,10-,11+/m0/s1
InChIKeyUBUDHORULOYWEA-BKDNQFJXSA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - DOI (10.1016/j.tet.2016.06.019)
ChEBI Ontology
Outgoing Relation(s)
(+)-applanatumol X (CHEBI:198867) is a chromones (CHEBI:23238)
IUPAC Name 
(1S,3aS,9aR)-7-hydroxy-9-oxo-2,3,3a,9a-tetrahydro-1H-cyclopenta[b]chromene-1-carboxylic acid
Manual XrefsDatabases
78440751ChemSpider