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CHEBI:215270 - Deschloro 12-epi-fischerindole I nitrile

ChEBI IDCHEBI:215270
ChEBI NameDeschloro 12-epi-fischerindole I nitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22N2
Net Charge0
Average Mass302.421
Monoisotopic Mass302.17830
SMILESC=C[C@]1(C)CC[C@H]2C(=C1C#N)c1c(nc3ccccc13)C2(C)C
InChIInChI=1S/C21H22N2/c1-5-21(4)11-10-14-18(15(21)12-22)17-13-8-6-7-9-16(13)23-19(17)20(14,2)3/h5-9,14,23H,1,10-11H2,2-4H3/t14-,21+/m0/s1
InChIKeyKTONQTZUWGFNIE-LHSJRXKWSA-N
Species of MetaboliteComponentSourceComments
Fischerellaspecies (ncbitaxon:1191) - PubMed (22470225)
ChEBI Ontology
Outgoing Relation(s)
Deschloro 12-epi-fischerindole I nitrile (CHEBI:215270) is a indoles (CHEBI:24828)
IUPAC Name 
(6aS,9S)-9-ethenyl-6,6,9-trimethyl-5,6a,7,8-tetrahydroindeno[2,1-b]indole-10-carbonitrile
Manual XrefsDatabases
75565299ChemSpider