Thesinine
Thesinine is a saturated pyrrolizidine alkaloid isolated from the seeds and flowers of *Borago officinalis*; it is the primary alkaloid in borage seeds and the only alkaloid present in borage flowers. In silico predictions indicate that Thesinine binds to the AKT1, MAPK3, MMP9, and MAPK14 proteins. Thesinine is applicable to research related to skin aging
For research use only. We do not sell to patients.
- CAS No.: 488-02-8
- Formula: C17H21NO3
- Molecular Weight:287.35
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Storage:
Please store the product under the recommended conditions in the Certificate of Analysis.
Biological Activity
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Akt1 |
MMP9 |
MAPK3 |
MAPK14 |
Thesinine forms energetically favorable interactions with human AKT1 (allosteric site), MAPK3, MMP9, and MAPK14 proteins, among which it exhibits the highest binding affinity for AKT1 (allosteric site)[1].
Thesinine forms stable and persistent interactions with human AKT1 (allosteric site) and MMP9 proteins during 100 ns molecular dynamics simulations, but its binding stability with human MAPK14 is reduced[1].
Thesinine is the sole alkaloid in the flowers of borage (Borago officinalis) and also the major alkaloid in mature seeds[2].
Thesinine is the only detected alkaloid in a batch of immature seeds, while it is not detected in any of the three seed oil samples[2].
MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.
Chemical Information
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CAS No. 488-02-8
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Molecular Weight 287.35
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Formula C17H21NO3
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SMILES
OC(C=C1)=CC=C1/C=C/C(OC[C@H]2[C@]3([H])N(CCC3)CC2)=O
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Structure Classification
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Initial Source
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Shipping
Room temperature in continental US; may vary elsewhere.
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Storage
Please store the product under the recommended conditions in the Certificate of Analysis.
Purity & Documentation
References
Calculators
Concentration (start) × Volume (start) = Concentration (final) × Volume (final)