Structure Database (LMSD)

Common Name
oct-1-en-3-ol
Systematic Name
oct-1-en-3-ol
Synonyms
  • 1-Octen-3-ol
  • 1-vinylhexanol
  • 3-hydroxy-1-octene
  • mushroom alcohol
  • octene-1-ol-3
  • vinyl amyl carbinol
  • vinyl hexanol
LM ID
LMFA05000090
Formula
Exact Mass
Calculate m/z
128.120115
Sum Composition
Status
Curated


Classification

Category
Main Class
Sub Class

Biological Context

1-Octen-3-ol is a volatile organic compound (VOC) that has been found in fungi and plants.1 It has also been found in oxen breath and human sweat and is an attractant for Ochlerotatus, Psorophora, Anopheles, and Coquillettidia mosquitoes but a repellant for Culex mosquitoes.1,2 1-Octen-3-ol (3 and 10 ppm) inhibits dopamine uptake in HEK cells expressing the human dopamine transporter (HEK-DAT cells).3 It induces dopaminergic neuron loss and locomotor deficits in, as well as reduces survival of, D. melanogaster when administered via inhalation at a dose of 0.5 ppm.

This information has been provided by Cayman Chemical

References

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Pleurotus ostreatus (#5322)
Agaricomycetes (#155619)
Volatile Compounds Secreted by the Oyster Mushroom (Pleurotus ostreatus) and Their Antibacterial Activities,
J Agric Food Chem, 1997

String Representations

InChiKey (Click to copy)
VSMOENVRRABVKN-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3
SMILES (Click to copy)
C(C(CCCCC)O)=C

Other Databases

Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 9
Rings 0
Aromatic Rings 0
Rotatable Bonds 5
Van der Waals Molecular Volume 153.11
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 2.40
Molar Refractivity 40.86

Admin

Created at
-
Updated at
-