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CHEBI:204314 - Commnesin 470

ChEBI IDCHEBI:204314
ChEBI NameCommnesin 470
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SubmitterMetaboLights
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FormulaC28H30N4O3
Net Charge0
Average Mass470.573
Monoisotopic Mass470.23179
SMILESCC(=O)N1CCC23c4ccccc4NC4N(C=O)c5cccc6c5C42CCN(C6C2OC2(C)C)C13
InChIInChI=1S/C28H30N4O3/c1-16(34)30-13-11-27-18-8-4-5-9-19(18)29-24-28(27)12-14-31(25(27)30)22(23-26(2,3)35-23)17-7-6-10-20(21(17)28)32(24)15-33/h4-10,15,22-25,29H,11-14H2,1-3H3
InChIKeyQGIMLRUKZYMMEV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium expansum (ncbitaxon:27334) - PubMed (19918940)
ChEBI Ontology
Outgoing Relation(s)
Commnesin 470 (CHEBI:204314) is a pyridoindole (CHEBI:48888)
IUPAC Name 
3-acetyl-25-(3,3-dimethyloxiran-2-yl)-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-15-carbaldehyde
Manual XrefsDatabases
27022871ChemSpider