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CHEBI:226592 - Columbamide H

ChEBI IDCHEBI:226592
ChEBI NameColumbamide H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H44ClNO3
Net Charge0
Average Mass418.062
Monoisotopic Mass417.30097
SMILESCCCCCCCCC(Cl)CCCC/C=C/CCC(=O)N(C)[C@H](CO)COC
InChIInChI=1S/C23H44ClNO3/c1-4-5-6-7-10-13-16-21(24)17-14-11-8-9-12-15-18-23(27)25(2)22(19-26)20-28-3/h9,12,21-22,26H,4-8,10-11,13-20H2,1-3H3/b12-9+/t21?,22-/m1/s1
InChIKeyFTZLVCBIANZKJT-GEQHOJJFSA-N
Species of MetaboliteComponentSourceComments
Moorena bouillonii (ncbitaxon:207920) - PubMed (32432877)
ChEBI Ontology
Outgoing Relation(s)
Columbamide H (CHEBI:226592) is a fatty amide (CHEBI:29348)
IUPAC Name 
(E)-10-chloro-N-[(2R)-1-hydroxy-3-methoxypropan-2-yl]-N-methyloctadec-4-enamide
Manual XrefsDatabases
85297369ChemSpider