ImmunoCR
A repository of plant based immunomodulatory compounds
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Nutraceutical Profile

ImmunCR Id : ICR41
Chemical Name : Α-Carotene
Plant Source : Solanum lycopersicum
Nutraceutical information : Edible, fresh vegetables (tomato, carrot, pumpkin, etc.), fruits (kiwifruit, pomelo, grapefruit, etc.), and bright-colored flowers (chrysanthemum, marigold, lonicera japonica, etc.), algae
Mode of administration : Dietary, injection, supplements
Immunomodulatory mechanism : Neuroprotective (anti-Alzheimer disease properties by inhibiting key enzymes relevant to this ailment, such as acetylcholinesterase, butyrylcholinesterase, and β-secretase); anti-cancer (lung carcinoma, prostate, breast, bladder, gastric cancer); cardioprotective (beneficial changes in heart rate variability); bone health (less likely to have lumbar spine osteoporosis); obesity treatment; improved gut microbiota; Used in the treatment of type 2 diabetes; Higher intakes of α-carotene might protect against NHL (Non-Hodgkin lymphoma) development.
Description : It is the most common form of carotene with a β-ionone and α-ionone ring. It is a precursor of vitamin A, present in abundance in adipose tissue and liver in humans and present on membrane or can be extracellular. The increase in intake of blood α-carotene, β-carotene, and β-cryptoxanthin was associated with approximately 2% longer telomeres in the 1999–2002 National Health and Nutrition of US adults Examination Survey. Similarly, low α-carotene intake was associated with higher asthma risk.

Chemical Structure Information

IUPAC Name 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene  
SMILES CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@H]2C(=CCCC2(C)C)C)/C)/C
Formula C40H56
InchiKey ANVAOWXLWRTKGA-NTXLUARGSA-N

Chemical Classification

Kingdom Organic compounds
Superclass Lipids and lipid-like molecules
Class Prenol lipids
Subclass Tetraterpenoids

Physicochemical properties

LogP 11.803
Molecular weight 536.873
Hydrogen Bond Acceptor 0
Hydrogen Bond Donor 0
Polar surface area 0
No. of rotatable bonds 10
Number of Aromatic Rings 0
Number of rings 2

ADMET Properties

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

Other Biological Properties

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References

    1. https://doi.org/10.1002/fft2.129
    2. https://doi.org/10.3390/molecules25235573
    3. https://doi.org/10.1002/jsfa.11966
    4. https://doi.org/10.1007/978-4-431-67017-9_105


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