EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:231653 - (19E)-cur-19-en-17-al(1+)

ChEBI IDCHEBI:231653
ChEBI Name(19E)-cur-19-en-17-al(1+)
Stars
ASCII Name(19E)-cur-19-en-17-al(1+)
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC19H23N2O
Net Charge+1
Average Mass295.406
Monoisotopic Mass295.18049
SMILES[H][C@]1(C=O)[C@]2([H])Nc3ccccc3[C@@]23CC[NH+]2C/C(=C/C)[C@]1([H])C[C@H]23
InChIInChI=1S/C19H22N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h2-6,11,13-14,17-18,20H,7-10H2,1H3/p+1/b12-2-/t13-,14+,17-,18-,19+/m0/s1
InChIKeyGOUXXPLYMIUQLE-MGOMBJFSSA-O
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(19E)-cur-19-en-17-al(1+) (CHEBI:231653) is a aldehyde (CHEBI:17478)
(19E)-cur-19-en-17-al(1+) (CHEBI:231653) is a ammonium ion derivative (CHEBI:35274)
(19E)-cur-19-en-17-al(1+) (CHEBI:231653) is a monoterpenoid indole alkaloid (CHEBI:65323)
(19E)-cur-19-en-17-al(1+) (CHEBI:231653) is a organic heteropentacyclic compound (CHEBI:38164)
Synonym  Source
desoxy-Wieland-Gumlich aldehydeSUBMITTER
UniProt Name  Source
(19E)-cur-19-en-17-alUniProt
Citations