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CHEBI:133364 - (Z)-4-hydroxy-3-methylbut-2-enal

Default Structure
ChEBI IDCHEBI:133364
ChEBI Name(Z)-4-hydroxy-3-methylbut-2-enal
Stars
ASCII Name(Z)-4-hydroxy-3-methylbut-2-enal
DefinitionAn enal that is 3-methylbut-2-enal carrying a hydroxy substituent at position 4 (the Z-geoisomer.
Last Modified27 February 2017
Submittermwilliams
DownloadsMolfile
FormulaC5H8O2
Net Charge0
Average Mass100.117
Monoisotopic Mass100.05243
SMILES[H]C(=O)/C=C(/C)CO
InChIInChI=1S/C5H8O2/c1-5(4-7)2-3-6/h2-3,7H,4H2,1H3/b5-2-
InChIKeyBSHDRMLUCYMQOP-DJWKRKHSSA-N
Species of MetaboliteComponentSourceComments
Glycine max (ncbitaxon:3847)
seed (BTO:0001226) MetaboLights (MTBLS117)
seed (BTO:0001226) MetaboLights (MTBLS118)
seed (BTO:0001226) PubMed (25369450)
ChEBI Ontology
Outgoing Relation(s)
(Z)-4-hydroxy-3-methylbut-2-enal (CHEBI:133364) is a enal (CHEBI:51688)
(Z)-4-hydroxy-3-methylbut-2-enal (CHEBI:133364) is a primary allylic alcohol (CHEBI:134394)
IUPAC Name 
(2Z)-4-hydroxy-3-methylbut-2-enal
Synonym  Source
(Z)-4-hydroxy-3-methyl-2-butenalChEBI
Manual XrefsDatabases
14441281ChemSpider
Registry NumbersSources
Reaxys:30194980Reaxys