EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:182821 - 15-Ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene

ChEBI IDCHEBI:182821
ChEBI Name15-Ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22N2O
Net Charge0
Average Mass306.409
Monoisotopic Mass306.17321
SMILESC=CC12CN(C)C3CC14C(=Nc1ccccc14)C1CC2C3CO1
InChIInChI=1S/C20H22N2O/c1-3-19-11-22(2)16-9-20(19)13-6-4-5-7-15(13)21-18(20)17-8-14(19)12(16)10-23-17/h3-7,12,14,16-17H,1,8-11H2,2H3
InChIKeyVTLYEMHGPMGUOT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
15-Ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene (CHEBI:182821) is a indoles (CHEBI:24828)
IUPAC Name 
15-ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene
Manual XrefsDatabases
4477308ChemSpider