EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:200000 - 4,6-Dihydroxy-3,9-dehydromellein

ChEBI IDCHEBI:200000
ChEBI Name4,6-Dihydroxy-3,9-dehydromellein
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H8O5
Net Charge0
Average Mass208.169
Monoisotopic Mass208.03717
SMILESC=C1OC(=O)c2c(O)cc(O)cc2[C@H]1O
InChIInChI=1S/C10H8O5/c1-4-9(13)6-2-5(11)3-7(12)8(6)10(14)15-4/h2-3,9,11-13H,1H2/t9-/m0/s1
InChIKeyCDIRPHSIKVTLRY-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Graphis proserpens (ncbitaxon:996888) - PubMed (21612806)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4,6-Dihydroxy-3,9-dehydromellein (CHEBI:200000) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
4,6,8-trihydroxy-3-methylidene-4H-isochromen-1-one
Manual XrefsDatabases
60687818ChemSpider