General
Preferred name
Methyl 4-hydroxycinnamate
Synonyms
Methyl p-coumarate ()
(E)-Methyl 4-coumarate ()
Methyl trans-p-coumarate ()
OMpCA ()
Methyl Trans-P-Coumaric Acid ()
Methyl-P-Coumarate ()
P-Hydroxy Cinnamic Acid Methyl Ester ()
Methyl 3-(4-Hydroxyphenyl)Acrylate ()
METHYL P-HYDROXYCINNAMATE ()
P&D ID
PD087027
CAS
3943-97-3
19367-38-5
Tags
natural product
available
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()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
Compound Sets
4
Cayman Chemical Bioactives
Other bioactive compounds
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
178.06
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
1
Aromatic Ring Count
1
cLogP
1.58
TPSA
46.53
Fraction CSP3
0.1
Chiral centers
0.0
Largest ring
6.0
QED
0.55
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Apoptosis
Target
Fungal
Bacterial
Source data
