ImmunoCR
A repository of plant based immunomodulatory compounds
ImmunoCR
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Nutraceutical Profile

ImmunCR Id : ICR5
Chemical Name : Quercetin
Plant Source : Mango seed
Nutraceutical information : Edible, apples, berries, Brassica vegetables, capers, grapes, onions, shallots, tea, tomatoes, nuts.
Mode of administration : Oral
Immunomodulatory mechanism : Antioxidant (reduced GSH concentrations, glutathione reductase activity); Anaphylatic reaction (decreased immunoglobulin E response, plasma histamine); Cardioprotective (inhibits platelet aggregation and thrombus formation); Diabetes (inhibits Aldose reductase); Anti-inflammatory (inhibits COX (cyclooxygenase), LOX (lipoxygenase), LPS-induced IL-8 and TNF-α, NO production, and (NOS) expression, tyrosine phosphorylation of JAK2, TYK2, STAT3, and STAT4); Antinociceptive (inhibits pronociceptive cytokine production, free radical generation, and influence L-arginine-nitric oxide, serotonin, gabaergic); Anxiety and Depression (decrease brain corticotropin-releasing factor (CRF) expression, increases plasma corticosterone and adrenocorticotropic hormone); Sleep (activates GABA(A) receptors); Anti-cancer (modulation of MEK/ERK and Nrf2/keap1 transduction signalling pathways, inhibit the tyrosine kinase activity)
Description : As per nomencleature Quercetin is known as 3,3',4',5,7-pentahydroxyflavanone belonging to the flavanone class with hydroxyl group at 3, 5, 7, 3', and 4' positions, it is citron yellow in color, showing solubility in alcohol and lipids but not water but partial solubility in hot water.

Chemical Structure Information

IUPAC Name 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one
SMILES C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O
Formula C15H10O7
InchiKey REFJWTPEDVJJIY-UHFFFAOYSA-N

Chemical Classification

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Flavonoids
Subclass Flavones

Physicochemical properties

LogP 1.63
Molecular weight 302.236
Hydrogen Bond Acceptor 7
Hydrogen Bond Donor 5
Polar surface area 130.308
No. of rotatable bonds 1
Number of Aromatic Rings 2
Number of rings 3

ADMET Properties

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

Other Biological Properties

  • Gatroprotective, Hypertension, Antimicrobial

References

    1. https://doi.org/10.1016/j.tifs.2016.06.010
    2. https://doi.org/10.3390/nu8030167


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