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CHEBI:218346 - Novoamauromine

ChEBI IDCHEBI:218346
ChEBI NameNovoamauromine
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H36N4O2
Net Charge0
Average Mass508.666
Monoisotopic Mass508.28383
SMILESC=CC(C)(C)[C@]12C[C@H]3C(=O)N4[C@H]5Nc6ccccc6[C@@]5(C(C)(C)C=C)C[C@H]4C(=O)N3[C@H]1Nc1ccccc12
InChIInChI=1S/C32H36N4O2/c1-7-29(3,4)31-17-23-25(37)36-24(26(38)35(23)27(31)33-21-15-11-9-13-19(21)31)18-32(30(5,6)8-2)20-14-10-12-16-22(20)34-28(32)36/h7-16,23-24,27-28,33-34H,1-2,17-18H2,3-6H3/t23-,24-,27+,28+,31-,32-/m0/s1
InChIKeyVKEAHNPKYMHYJJ-CUZDTQNASA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (20460802)
ChEBI Ontology
Outgoing Relation(s)
Novoamauromine (CHEBI:218346) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
(1S,4R,12S,14S,17R,25S)-12,25-bis(2-methylbut-3-en-2-yl)-3,5,16,18-tetrazaheptacyclo[14.10.0.03,14.04,12.06,11.017,25.019,24]hexacosa-6,8,10,19,21,23-hexaene-2,15-dione
Manual XrefsDatabases
28287546ChemSpider