EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:214546 - (E)-N-[(E,2Z)-2-(chloromethylidene)-4-methoxy-6-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-oxohex-4-enyl]-7-hydroxy-N-methyltetradec-4-enamide

ChEBI IDCHEBI:214546
ChEBI Name(E)-N-[(E,2Z)-2-(chloromethylidene)-4-methoxy-6-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-oxohex-4-enyl]-7-hydroxy-N-methyltetradec-4-enamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H43ClN2O6
Net Charge0
Average Mass539.113
Monoisotopic Mass538.28096
SMILESCCCCCCC[C@H](O)C/C=C/CCC(=O)N(C)C/C(=C\Cl)C/C(=C\C(=O)N1CC(OC)=CC1=O)OC
InChIInChI=1S/C28H43ClN2O6/c1-5-6-7-8-10-13-23(32)14-11-9-12-15-26(33)30(2)20-22(19-29)16-24(36-3)17-27(34)31-21-25(37-4)18-28(31)35/h9,11,17-19,23,32H,5-8,10,12-16,20-21H2,1-4H3/b11-9+,22-19-,24-17+/t23-/m0/s1
InChIKeyYJGBARQRQUFWTE-FJWWRBHTSA-N
Species of MetaboliteComponentSourceComments
Moorena producens (ncbitaxon:1155739) - PubMed (28595450)
ChEBI Ontology
Outgoing Relation(s)
(E)-N-[(E,2Z)-2-(chloromethylidene)-4-methoxy-6-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-oxohex-4-enyl]-7-hydroxy-N-methyltetradec-4-enamide (CHEBI:214546) is a fatty amide (CHEBI:29348)
IUPAC Name 
(E)-N-[(E,2Z)-2-(chloromethylidene)-4-methoxy-6-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-6-oxohex-4-enyl]-7-hydroxy-N-methyltetradec-4-enamide
Manual XrefsDatabases
62702371ChemSpider