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CAS 69257-04-1

:

Cinchonanium, 9-hydroxy-1-(phenylmethyl)-, chloride, (8α,9R)-

Description:
Cinchonanium, 9-hydroxy-1-(phenylmethyl)-, chloride, (8α,9R)-, with the CAS number 69257-04-1, is a chemical compound derived from cinchona alkaloids, known for their complex structure and biological activity. This substance typically exhibits characteristics associated with quaternary ammonium compounds, including a positively charged nitrogen atom, which contributes to its solubility in polar solvents. The presence of a hydroxyl group and a phenylmethyl substituent enhances its potential for hydrogen bonding and interactions with biological targets. Cinchonanium compounds are often studied for their pharmacological properties, including antimalarial and analgesic effects, owing to their structural similarity to quinine and other cinchona derivatives. The specific stereochemistry indicated by (8α,9R) suggests a particular three-dimensional arrangement that may influence its biological activity and interaction with receptors. As with many alkaloids, the compound may also exhibit chiral properties, which can affect its efficacy and safety profile in therapeutic applications. Overall, cinchonanium chloride represents a fascinating area of study within medicinal chemistry and pharmacology.
Formula:C26H29N2O·Cl
InChI:InChI=1S/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20-,21-,25-,26+,28+;/m0./s1
InChI key:InChIKey=FCHYSBWCOKEPNQ-SPTWEYDNSA-M
SMILES:C([N@@+]12[C@]([C@H](O)C=3C4=C(N=CC3)C=CC=C4)(C[C@@]([C@@H](C=C)C1)(CC2)[H])[H])C5=CC=CC=C5.[Cl-]
Synonyms:
  • (-)-1-Benzylcinchonidinium chloride
  • (-)-N-Benzylcinchonadinium chloride
  • (8S,9R)-(-)-N-Benzylcinchonidinium chloride
  • (8a,9R)-1-Benzyl-9-hydroxycinchonanium chloride
  • Cinchonan-1-Ium-9-Ol, 1-(Phenylmethyl)-, Hydrochloride
  • Cinchonanium, 9-hydroxy-1-(phenylmethyl)-, chloride, (8α,9R)-
  • (-)-N-Benzylcinchonidinium chloride
  • N-Benzylcinchonidinium chloride
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