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CHEBI:229631 - Auraptenol

ChEBI IDCHEBI:229631
ChEBI NameAuraptenol
Stars
Last Modified8 November 2024
Submitterntejera
DownloadsMolfile
FormulaC15H16O4
Net Charge0
Average Mass260.289
Monoisotopic Mass260.10486
SMILESC=C(C)[C@@H](O)Cc1c(OC)ccc2ccc(=O)oc12
InChIInChI=1S/C15H16O4/c1-9(2)12(16)8-11-13(18-3)6-4-10-5-7-14(17)19-15(10)11/h4-7,12,16H,1,8H2,2-3H3/t12-/m0/s1
InChIKeySQSRYWNOKPJENY-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) - MetaboLights (MTBLS7859)
ChEBI Ontology
Outgoing Relation(s)
Auraptenol (CHEBI:229631) is a coumarins (CHEBI:23403)
IUPAC Name 
8-[(2S)-2-hydroxy-3-methylbut-3-enyl]-7-methoxychromen-2-one