Phyto4Health

Butyl Alcohol

Representations & DB's id

ChEBI: CHEBI:28885
ChEMBL: CHEMBL14245
PubChem: 263
IUPAC: butan-1-ol
Standard InChI: InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
Standard InChI Key: LRHPLDYGYMQRHN-UHFFFAOYSA-N
SMILES: CCCCO

Molecular propeties

AlogP: 0.78
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 2
Number of rings: 0
Molecular Weight: 74.07
Topological polar surface area: 20.2
Number of aromatic rings: 0
Fsp3: 1
Number of carbons: 4

Plant sources

Part of plant Plant name Ref.
PlantVaccinium vitis-idaea
PlantVitis vinifera

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency39810.7 nMAldehyde dehydrogenase 1A1P00352