Benzoylmesaconine

For research use only. Not for therapeutic Use.

  • CAT Number: I004384
  • CAS Number: 63238-67-5
  • Molecular Formula: C31H43NO10
  • Molecular Weight: 589.67
  • Purity: ≥95%
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Benzoylmesaconine (Cat.No:I004384) is a natural product derived from the roots of Aconitum plants. It has been found to possess anti-inflammatory, analgesic, and antipyretic properties. Benzoylmesaconine is being studied for its potential therapeutic applications in pain management and inflammatory disorders. However, it can be toxic if ingested or applied topically in excessive amounts, and caution must be taken when handling it.


Catalog Number I004384
CAS Number 63238-67-5
Molecular Formula C31H43NO10
Purity ≥95%
Solubility 10 mM in DMSO
Storage Store at -20°C
IUPAC Name [(1S,2R,3R,4R,5R,6S,7S,8R,9R,13R,14R,16S,17S,18R)-5,7,8,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
InChI [(1S,2R,3R,4R,5R,6S,7S,8R,9R,13R,14R,16S,17S,18R)-5,7,8,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
InChIKey PULWZCUZNRVAHT-IJNXHYLPSA-N
SMILES CN1CC2(C(CC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC)OC)O)COC
Reference

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<br>[1]. Dai PM, et al. Pharmacokinetic comparisons of benzoylmesaconine in rats using ultra-performance liquid chromatography-tandem mass spectrometry after administration of pure benzoylmesaconine and Wutou decoction. Molecules. 2014 Oct 17;19(10):16757-69.

<br>[2]. Ye L, et al. Monoester-Diterpene Aconitum Alkaloid Metabolism in Human Liver Microsomes: Predominant Role of CYP3A4 and CYP3A5. Evid Based Complement Alternat Med. 2013;2013:941093.

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