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CHEBI:16605 - allyl alcohol

ChEBI IDCHEBI:16605
ChEBI Nameallyl alcohol
Stars
DefinitionA propenol in which the C=C bond connects C-2 and C-3. It is has been found in garlic (Allium sativum). Formerly used as a herbicide for the control of various grass and weed seeds.
Secondary ChEBI IDsCHEBI:2604, CHEBI:13763, CHEBI:19765
Last Modified1 February 2017
DownloadsMolfile
FormulaC3H6O
Net Charge0
Average Mass58.080
Monoisotopic Mass58.04186
SMILESC=CCO
InChIInChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2
InChIKeyXXROGKLTLUQVRX-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
fungicide  A substance used to destroy fungal pests.
Applications:
insecticide  Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
herbicide  A substance used to destroy plant pests.
fungicide  A substance used to destroy fungal pests.
ChEBI Ontology
Outgoing Relation(s)
allyl alcohol (CHEBI:16605) has role antibacterial agent (CHEBI:33282)
allyl alcohol (CHEBI:16605) has role fungicide (CHEBI:24127)
allyl alcohol (CHEBI:16605) has role herbicide (CHEBI:24527)
allyl alcohol (CHEBI:16605) has role insecticide (CHEBI:24852)
allyl alcohol (CHEBI:16605) has role plant metabolite (CHEBI:76924)
allyl alcohol (CHEBI:16605) is a primary allylic alcohol (CHEBI:134394)
allyl alcohol (CHEBI:16605) is a propenol (CHEBI:26300)
Incoming Relation(s)
allyl diphosphate (CHEBI:62888) has functional parent allyl alcohol (CHEBI:16605)
allyl octadecyl oxalate (CHEBI:84271) has functional parent allyl alcohol (CHEBI:16605)
allyl-UTP (CHEBI:62893) has functional parent allyl alcohol (CHEBI:16605)
IUPAC Name 
prop-2-en-1-ol
Synonyms  Source
Allyl alcoholKEGG COMPOUND
2-Propen-1-olKEGG COMPOUND
2-PropenolChemIDplus
2-Propenyl alcoholChemIDplus
3-HydroxypropeneChemIDplus
VinylcarbinolChemIDplus
UniProt Name  Source
allyl alcoholUniProt
Manual XrefsDatabases
C02001KEGG COMPOUND
Allyl_alcoholWikipedia
ALLYL-ALCOHOLMetaCyc
HMDB0031652HMDB
2698PPDB
Registry NumbersSources
Reaxys:605307Reaxys
CAS:107-18-6KEGG COMPOUND
CAS:107-18-6ChemIDplus
Citations