CAS 67174-25-8

Cinchonanium, 9-hydroxy-6′-methoxy-1-(phenylmethyl)-, chloride, (8α,9R)-

Description:

Cinchonanium, 9-hydroxy-6′-methoxy-1-(phenylmethyl)-, chloride, (8α,9R)- is a chemical compound that belongs to the class of cinchona alkaloids, which are derived from the bark of the cinchona tree. This substance is characterized by its complex molecular structure, featuring a quinoline backbone with various functional groups, including a hydroxyl group and a methoxy group, which contribute to its biological activity. The presence of the phenylmethyl group enhances its lipophilicity, potentially influencing its interaction with biological membranes. As a chloride salt, it is typically encountered in a crystalline form, which may exhibit solubility in polar solvents. Cinchonanium compounds are known for their pharmacological properties, including antimalarial and analgesic effects, attributed to their ability to interfere with certain biochemical pathways. The specific stereochemistry indicated by the (8α,9R) designation suggests a particular three-dimensional arrangement that may be crucial for its biological activity. Overall, this compound represents a significant interest in medicinal chemistry and pharmacology.

Formula: C₂₇H₃₁N₂O₂·Cl

InChI: InChI=1S/C27H31N2O2.ClH/c1-3-20-18-29(17-19-7-5-4-6-8-19)14-12-21(20)15-26(29)27(30)23-11-13-28-25-10-9-22(31-2)16-24(23)25;/h3-11,13,16,20-21,26-27,30H,1,12,14-15,17-18H2,2H3;1H/q+1;/p-1/t20-,21-,26-,27+,29+;/m0./s1

InChI key: InChIKey=JYDIJFKNXHPWBJ-GOGFHWEMSA-M

SMILES: C([N@@+]12[C@]([C@H](O)C=3C4=C(C=CC(OC)=C4)N=CC3)(C[C@@]([C@@H](C=C)C1)(CC2)[H])[H])C5=CC=CC=C5.[Cl-]

Synonyms:

• (3α,9S)-1-benzyl-6'-methoxycinchonan-1-ium-9-ol chloride
• (8a,9R)-1-benzyl-6'-methoxycinchonan-1-ium-9-ol chloride
• (8alpha,9R)-1-Benzyl-9-hydroxy-6'-methoxycinchonan-1-ium chloride
• (8alpha,9R)-1-benzyl-6'-methoxycinchonan-1-ium-9-ol chloride
• 1-Benzylquininium chloride
• Cinchonanium, 9-hydroxy-6′-methoxy-1-(phenylmethyl)-, chloride, (8α,9R)-
• Quibec
• N-Benzylquininium chloride
• (-)-N-Benzylquininium chloride

N-Benzylquininium chloride, 95%

CAS: 67174-25-8

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₂₇H₃₁ClN₂O₂

Purity: 95%

Molecular weight: 451.01

Ref: 02-H53424

N-Benzylquininium Chloride

CAS: 67174-25-8

Formula: C₂₇H₃₁ClN₂O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 451.0002

Ref: IN-DA00FCVS

N-Benzylquinine (chloride)

CAS: 67174-25-8

N-Benzylquinine (chloride)

Purity: 95%

Molecular weight: 451g/mol

Ref: 54-OR1006490

N-Benzylquinine (chloride)

CAS: 67174-25-8

Purity: 95%

Molecular weight: 450.21

Ref: 10-F556404