ImmunoCR
A repository of plant based immunomodulatory compounds
ImmunoCR
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Nutraceutical Profile

ImmunCR Id : ICR96
Chemical Name : Tymol
Plant Source : Thymus vulgaris L. Lamiaceae
Nutraceutical information : Edible, Clove
Mode of administration : ---
Immunomodulatory mechanism : Anti-inflammatory; Anti-bacterial against Aeromonas hydrophila
Description : Tymol is a monoterpene found in many essential oils, it contains hydroxyl group at positions C-3 and C-2.

Chemical Structure Information

IUPAC Name N-(4-hydroxyphenyl)acetamide  
SMILES CC(=O)NC1=CC=C(C=C1)O
Formula C8H9NO2
InchiKey RZVAJINKPMORJF-UHFFFAOYSA-N

Chemical Classification

Kingdom Organic compounds
Superclass Benzenoids
Class Phenols
Subclass ---

Physicochemical properties

LogP 0.708
Molecular weight 151.163
Hydrogen Bond Acceptor 2
Hydrogen Bond Donor 2
Polar surface area 50.926
No. of rotatable bonds 1
Number of Aromatic Rings 1
Number of rings 1

ADMET Properties

Absorption level Good
Solubility level Very Soluble
Blood Brain Barrier Low
Plasma protein binding Non-Binder
CYP2D6 inhibition Non-Inhibitor

Other Biological Properties

  • ---

References

    1. https://doi.org/10.13040/IJPSR.0975-8232.12(10).5229-37
    2. https://aquadocs.org/handle/1834/10834?show=full&locale-attribute=fr


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