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CHEBI:212708 - Communesin K

ChEBI IDCHEBI:212708
ChEBI NameCommunesin K
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SubmitterMetaboLights
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FormulaC26H30N4
Net Charge0
Average Mass398.554
Monoisotopic Mass398.24705
SMILESCC(C)=C[C@@H]1c2cccc3c2[C@]24CCN1[C@H]1NCC[C@]12c1ccccc1N[C@@H]4N3C
InChIInChI=1S/C26H30N4/c1-16(2)15-21-17-7-6-10-20-22(17)26-12-14-30(21)23-25(26,11-13-27-23)18-8-4-5-9-19(18)28-24(26)29(20)3/h4-10,15,21,23-24,27-28H,11-14H2,1-3H3/t21-,23-,24-,25+,26+/m1/s1
InChIKeyGEEJHYAUAXKQLB-YQVWZVKMSA-N
Species of MetaboliteComponentSourceComments
Penicillium expansum (ncbitaxon:27334) - PubMed (25571861)
ChEBI Ontology
Outgoing Relation(s)
Communesin K (CHEBI:212708) is a pyridoindole (CHEBI:48888)
IUPAC Name 
(2R,6R,14R,22R,25R)-15-methyl-25-(2-methylprop-1-enyl)-1,3,13,15-tetrazaheptacyclo[18.4.1.02,6.06,22.07,12.014,22.016,21]pentacosa-7,9,11,16,18,20-hexaene
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58197329ChemSpider