General
Preferred name
P-Hydroxybenzaldehyde
Synonyms
4-Formylphenol ()
4-HYDROXYBENZALDEHYDE ()
p-Oxybenzaldehyde ()
4-Hydroxybenzaldehyde, 4-Formylphenol, p-Formylphenol ()
P&D ID
PD006812
CAS
65581-83-1
123-08-0
Tags
available
drug candidate
natural product
Drug indication
Discovery agent
Drug Status
experimental
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
p-Hydroxybenzaldehyde is a one of the major components in vanilla aroma, with antagonistic effect on GABAA receptor of the ¦Á1¦Â2¦Ã2S subtype at high concentrations.
PRICE
29
DESCRIPTION
4-hydroxybenzaldehyde is a plant-derived bioactive compound. It has been detected in Spiranthes vernalis (the Spring Ladies' Tresses orchid) and Rhinacanthus nasutus (snake jasmine).
4-hydroxybenzaldehyde was investigated for anti-coronavirus activity in response to the COVID-19 pandemic. It binds at an allosteric site of SARS-CoV-2 papain-like protease (PLpro) that disrupts both the deubiquitinase activity of PLpro and its interactions with interferon-stimulated gene product 15 (ISG15)-modified host proteins . (GtoPdb)
4-hydroxybenzaldehyde was investigated for anti-coronavirus activity in response to the COVID-19 pandemic. It binds at an allosteric site of SARS-CoV-2 papain-like protease (PLpro) that disrupts both the deubiquitinase activity of PLpro and its interactions with interferon-stimulated gene product 15 (ISG15)-modified host proteins . (GtoPdb)
DESCRIPTION
4-Hydroxybenzaldehyde maintains bactericidal activity. It also has antineoplastic activity.
(Enamine Bioactive Compounds)
DESCRIPTION
1. p-Hydroxybenzaldehyde (p-Oxybenzaldehyde) shows an inhibitory effect on the GABA transaminase to contribute to an antiepileptic and anticonvulsive activity, and its inhibitory activity was higher than that of valproic acid, a known anticonvulsant.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
2
Organisms
0
Compound Sets
7
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
40
Molecular Weight
122.04
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.2
TPSA
37.3
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.57
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
GABA Receptor
GABA transaminase
MOA
transaminase
Pathway
Membrane Transporter/Ion Channel
Metabolism
Neuroscience
Metabolic Enzyme/Protease
Neuronal Signaling
Source data
