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CHEBI:191182 - zearalenone hapten ZEo

ChEBI IDCHEBI:191182
ChEBI Namezearalenone hapten ZEo
Stars
ASCII Namezearalenone hapten ZEo
DefinitionA macrolide that is an immunizing hapten of the mycotoxin zearalenone which incorporates a carboxylated[(5-carboxypentyl)oxy]imino spacer arm through the carbonyl function at C-7.
Last Modified14 April 2022
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC24H35NO7
Net Charge0
Average Mass449.544
Monoisotopic Mass449.24135
SMILESC[C@H]1CCCC(NOCCCCCC(=O)O)CCC/C=C/c2cc(O)cc(O)c2C(=O)O1
InChIInChI=1S/C24H35NO7/c1-17-9-8-12-19(25-31-14-7-3-6-13-22(28)29)11-5-2-4-10-18-15-20(26)16-21(27)23(18)24(30)32-17/h4,10,15-17,19,25-27H,2-3,5-9,11-14H2,1H3,(H,28,29)/b10-4+/t17-,19?/m0/s1
InChIKeyRUWZGLIXFBNPKR-URELGRSRSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
hapten  Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
ChEBI Ontology
Outgoing Relation(s)
zearalenone hapten ZEo (CHEBI:191182) has functional parent zearalenone (CHEBI:10106)
zearalenone hapten ZEo (CHEBI:191182) has role hapten (CHEBI:59174)
zearalenone hapten ZEo (CHEBI:191182) is a macrolide (CHEBI:25106)
zearalenone hapten ZEo (CHEBI:191182) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
6-({[(3S,11E)-14,16-dihydroxy-3-methyl-1-oxo-1,3,4,5,6,8,9,10-octahydro-7H-2-benzoxacyclotetradecin-7-ylidene]amino}oxy)hexanoic acid
Synonyms  Source
6-((((SS,E)-14,16-dihydroxy-3-methyl-1-oxo-1,3,4,5,6,8,9,10-octahydro-7H-benz[c][1]oxacyclotetradecin-7-ylidene)amino)oxy)hexanoic acidChEBI
hapten ZEoChEBI
Citations