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CHEBI:209108 - Talacoumarin A

Default Structure
ChEBI IDCHEBI:209108
ChEBI NameTalacoumarin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O5
Net Charge0
Average Mass250.250
Monoisotopic Mass250.08412
SMILESCOc1cc(O)c2oc(=O)c(C[C@H](C)O)cc2c1
InChIInChI=1S/C13H14O5/c1-7(14)3-9-4-8-5-10(17-2)6-11(15)12(8)18-13(9)16/h4-7,14-15H,3H2,1-2H3/t7-/m0/s1
InChIKeyYQILNNCHDIUIAD-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - PubMed (25514227)
ChEBI Ontology
Outgoing Relation(s)
Talacoumarin A (CHEBI:209108) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-methoxychromen-2-one
Manual XrefsDatabases
78441479ChemSpider