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CHEBI:211988 - Hapalindole A

ChEBI IDCHEBI:211988
ChEBI NameHapalindole A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H25ClN2
Net Charge0
Average Mass340.898
Monoisotopic Mass340.17063
SMILESC=C[C@@]1(C)[C@H](Cl)C[C@H]2[C@H](c3cnc4cccc(c34)C2(C)C)[C@H]1N=C
InChIInChI=1S/C21H25ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,18-19,24H,1,5,10H2,2-4H3/t14-,16+,18-,19+,21-/m0/s1
InChIKeyWLYRDDVNMIRJMV-DJNKVENRSA-N
Species of MetaboliteComponentSourceComments
Hapalosiphon (ncbitaxon:162985) - DOI (10.1021/ja00333a079)
ChEBI Ontology
Outgoing Relation(s)
Hapalindole A (CHEBI:211988) is a indoles (CHEBI:24828)
IUPAC Name 
N-[(2R,3R,4R,5R,7S)-5-chloro-4-ethenyl-4,8,8-trimethyl-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),9(16),10,12-tetraen-3-yl]methanimine