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CHEBI:215476 - Talacoumarin B

Default Structure
ChEBI IDCHEBI:215476
ChEBI NameTalacoumarin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O5
Net Charge0
Average Mass250.250
Monoisotopic Mass250.08412
SMILESCOc1cc(O)cc2cc(C[C@H](C)O)c(=O)oc12
InChIInChI=1S/C13H14O5/c1-7(14)3-9-4-8-5-10(15)6-11(17-2)12(8)18-13(9)16/h4-7,14-15H,3H2,1-2H3/t7-/m0/s1
InChIKeyJJPPIWBBVUMFEW-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - PubMed (25514227)
ChEBI Ontology
Outgoing Relation(s)
Talacoumarin B (CHEBI:215476) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
6-hydroxy-3-[(2S)-2-hydroxypropyl]-8-methoxychromen-2-one
Manual XrefsDatabases
78441343ChemSpider