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CHEBI:198055 - Papupyrrolal

ChEBI IDCHEBI:198055
ChEBI NamePapupyrrolal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H17NO3
Net Charge0
Average Mass259.305
Monoisotopic Mass259.12084
SMILESCOc1ccc(CCOCc2ccc(C=O)n2)cc1
InChIInChI=1S/C15H17NO3/c1-18-15-6-2-12(3-7-15)8-9-19-11-14-5-4-13(10-17)16-14/h2-7,10,16H,8-9,11H2,1H3
InChIKeyWIDQDVZZRNCKCT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - DOI (10.1007/s10600-015-1327-3)
ChEBI Ontology
Outgoing Relation(s)
Papupyrrolal (CHEBI:198055) is a alcohol (CHEBI:30879)
Papupyrrolal (CHEBI:198055) is a phenols (CHEBI:33853)
IUPAC Name 
5-[2-(4-methoxyphenyl)ethoxymethyl]-1H-pyrrole-2-carbaldehyde
Manual XrefsDatabases
78435564ChemSpider