Phyto4Health

4-Hydroxybenzylamine

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL202519
PubChem: 97472
IUPAC: 4-(aminomethyl)phenol
Standard InChI: InChI=1S/C7H9NO/c8-5-6-1-3-7(9)4-2-6/h1-4,9H,5,8H2
Standard InChI Key: RQJDUEKERVZLLU-UHFFFAOYSA-N
SMILES: NCc1ccc(cc1)O

Molecular propeties

AlogP: 0.85
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 2
Rotatable bonds: 1
Number of rings: 1
Molecular Weight: 123.07
Topological polar surface area: 46.2
Number of aromatic rings: 1
Fsp3: 0.143
Number of carbons: 7

Plant sources

Part of plant Plant name Ref.
PlantBrassica juncea
PlantFagopyrum esculentum
PlantFagopyrum esculentum
PlantFagopyrum esculentum
PlantUrtica dioica
PlantUrtica dioica

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
IC501000000 nMSuccinate semialdehyde dehydrogenaseP51649
IC5015400 nMGamma-amino-N-butyrate transaminaseP80404