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CHEBI:216558 - Columbamide E

ChEBI IDCHEBI:216558
ChEBI NameColumbamide E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H42Cl3NO3
Net Charge0
Average Mass486.952
Monoisotopic Mass485.22303
SMILESCOC[C@@H](CO)N(C)C(=O)CCC=CCCCC[C@H](Cl)CCCCCCCC(Cl)Cl
InChIInChI=1S/C23H42Cl3NO3/c1-27(21(18-28)19-30-2)23(29)17-13-9-4-3-6-10-14-20(24)15-11-7-5-8-12-16-22(25)26/h4,9,20-22,28H,3,5-8,10-19H2,1-2H3/t20-,21+/m0/s1
InChIKeyVKISHKUYLSSBSY-LEWJYISDSA-N
Species of MetaboliteComponentSourceComments
Moorena bouillonii (ncbitaxon:207920) - PubMed (28783344)
ChEBI Ontology
Outgoing Relation(s)
Columbamide E (CHEBI:216558) is a fatty amide (CHEBI:29348)
IUPAC Name 
(10R)-10,18,18-trichloro-N-[(2R)-1-hydroxy-3-methoxypropan-2-yl]-N-methyloctadec-4-enamide