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CHEBI:216761 - Astepyrazinol A

ChEBI IDCHEBI:216761
ChEBI NameAstepyrazinol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H23N3O2
Net Charge0
Average Mass337.423
Monoisotopic Mass337.17903
SMILESCOc1nc(C)c(=O)nc1Cc1cnc2c(CC=C(C)C)cccc12
InChIInChI=1S/C20H23N3O2/c1-12(2)8-9-14-6-5-7-16-15(11-21-18(14)16)10-17-20(25-4)22-13(3)19(24)23-17/h5-8,11,21H,9-10H2,1-4H3,(H,23,24)
InChIKeyIYIDDZWELQEZRZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.tet.2020.131496)
ChEBI Ontology
Outgoing Relation(s)
Astepyrazinol A (CHEBI:216761) is a indoles (CHEBI:24828)
IUPAC Name 
5-methoxy-3-methyl-6-[[7-(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]-1H-pyrazin-2-one
Manual XrefsDatabases
101935344ChemSpider