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CHEBI:200478 - 12-epi-hapalindole J isonitrile

ChEBI IDCHEBI:200478
ChEBI Name12-epi-hapalindole J isonitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24N2
Net Charge0
Average Mass304.437
Monoisotopic Mass304.19395
SMILES[C-]#[N+][C@@H]1[C@H]2c3cnc4cccc(c34)C(C)(C)[C@H]2CC[C@@]1(C)C=C
InChIInChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18-,19+,21+/m0/s1
InChIKeySLUFHMQYBPOTFZ-XJRBWHPUSA-N
Species of MetaboliteComponentSourceComments
Fischerella (ncbitaxon:1190) - PubMed (17686499)
ChEBI Ontology
Outgoing Relation(s)
12-epi-hapalindole J isonitrile (CHEBI:200478) is a indoles (CHEBI:24828)
IUPAC Name 
(2R,3R,4S,7S)-4-ethenyl-3-isocyano-4,8,8-trimethyl-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),9(16),10,12-tetraene
Manual XrefsDatabases
28284588ChemSpider