General
Preferred name
ISOFERULIC ACID
Synonyms
Isoferulate ()
Hesperetic acid ()
3-Hydroxy-4-methoxycinnamic acid ()
Hesperetate ()
trans-Isoferulic acid ()
trans-3-Hydroxy-4-methoxycinnamic acid ()
Hesperetic acid, Hesperetate, Isoferulate ()
P&D ID
PD006097
CAS
537-73-5
25522-33-2
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Isoferulic acid (3-Hydroxy-4-methoxycinnamic acid) is an orally active cinnamic acid derivative. Isoferulic acid exhibits hypoglycemic, antiviral, and antioxidant activities. Isoferulic acid can also inhibit fructose- and glucose-mediated protein glycation. Isoferulic acid can be used in the research of diseases such as diabetes[1][2][3][4].
DESCRIPTION trans-Isoferulic acid (trans-3-Hydroxy-4-methoxycinnamic acid) is an aromatic acid isolated from the roots of Clematis florida var. plena. trans-Isoferulic acid exhibits anti-inflammatory activity[1].trans-isoferulic acid suppresses NO and PGE2 production through the induction of Nrf2-dependent heme oxygenase-1 (HO-1)[2].
PRICE 29
DESCRIPTION trans-Isoferulic acid is an aromatic acid isolated from the roots of Clematis florida var. plena. trans-Isoferulic acid exhibits anti-inflammatory activity. It has binding affinity against α1A-adrenoceptors. (Enamine Bioactive Compounds)
DESCRIPTION Isoferulic acid (Hesperetate) exhibits hypoglycemic properties. (TargetMol Bioactive Compound Library)
Compound Sets
7
DrugBank
DrugMAP
Enamine Bioactive Compounds
Guide to Pharmacology
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
33
Properties
(calculated by RDKit )
Molecular Weight
194.06
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
1.5
TPSA
66.76
Fraction CSP3
0.1
Chiral centers
0.0
Largest ring
6.0
QED
0.72
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Adrenergic Receptor
Influenza Virus
NO Synthase
Prostaglandin Receptor
Pathway
GPCR/G protein
Microbiology/virology
Neuroscience
Anti-infection
Neuronal Signaling
Immunology/Inflammation
Source data