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CHEBI:69929 - Xanthoxyletin

ChEBI IDCHEBI:69929
ChEBI NameXanthoxyletin
Stars
DefinitionA natural product found in Clausena harmandiana.
Last Modified22 September 2014
DownloadsMolfile
FormulaC15H14O4
Net Charge0
Average Mass258.273
Monoisotopic Mass258.08921
SMILESCOc1c2c(cc3oc(=O)ccc13)OC(C)(C)C=C2
InChIInChI=1S/C15H14O4/c1-15(2)7-6-10-12(19-15)8-11-9(14(10)17-3)4-5-13(16)18-11/h4-8H,1-3H3
InChIKeyJSJIIHRNDMLJGK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Clausena harmandiana (ncbitaxon:159036) root (BTO:0001188) PubMed (21302964) Crude ethyl acetate extract of air-dried, powdered roots.
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Xanthoxyletin (CHEBI:69929) has role metabolite (CHEBI:25212)
Xanthoxyletin (CHEBI:69929) is a coumarins (CHEBI:23403)
Synonyms  Source
5-methoxy-2,2-dimethylpyrano[3,2-g]chromen-8-oneChEBI
7-Hydroxy-5-methoxy-2,2-dimethyl-2H-1-benzopyran-6-acrylic Acid delta-LactoneChEBI
XanthoxyloinChEBI
Xanthoxylin NChEBI
Manual XrefsDatabases
HMDB0033931HMDB
Registry NumbersSources
CAS:84-99-1ChemIDplus
Citations