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CHEBI:181487 - 12-Epi-hapalindole C isoniltrile

ChEBI IDCHEBI:181487
ChEBI Name12-Epi-hapalindole C isoniltrile
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24N2
Net Charge0
Average Mass304.437
Monoisotopic Mass304.19395
SMILES[H][C@]1(c2cnc3ccccc23)[C@H](C(=C)C)CC[C@](C)(C=C)[C@H]1[N+]#[C-]
InChIInChI=1S/C21H24N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,11-12H2,3-4H3/t15-,19+,20-,21-/m0/s1
InChIKeyKGWATBYKCMCFLC-ZFCZOSEKSA-N
ChEBI Ontology
Outgoing Relation(s)
12-Epi-hapalindole C isoniltrile (CHEBI:181487) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
3-[(1R,2S,3R,6R)-3-ethenyl-2-isocyano-3-methyl-6-prop-1-en-2-ylcyclohexyl]-1H-indole
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