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辛可尼丁 | 485-71-2

辛可尼丁
Cinchonidine
485-71-2
C19H22N2O
294.3908
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:辛可尼丁结构式
24856544
辛可尼丁价格
简介
Cinchonidine (α-Quinidine) 是在金鸡纳和角蒿中发现的金鸡纳生物碱。 Cinchonidine (α-Quinidine) 是用于有机化学中不对称合成的砌块。是血清素转运蛋白 (SERT)的弱抑制剂,对于dSERT,hSERT,hSERT I172M,hSERT S438T,hSERT Y95F的 Ki 分别为330,4.2,36,196,15 μM。有抗疟活性.。
名称和标识符
MDL MFCD00006783
InChIKey KMPWYEUPVWOPIM-KODHJQJWSA-N
Inchi 1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18-,19+/m0/s1
SMILES O([H])[C@]([H])(C1=C([H])C([H])=NC2=C([H])C([H])=C([H])C([H])=C12)[C@]1([H])C([H])([H])[C@]2([H])C([H])([H])C([H])([H])N1C([H])([H])[C@]2([H])C([H])=C([H])[H]
BRN 89690
别名信息
- 中文别名 -
  • 辛可尼丁
  • (9S)-6'-甲氧基辛可宁-9-醇
  • 4-喹啉基-(5-乙烯基-1-氮杂双环[2.2.2]辛烷-2-基)甲醇
  • 辛可尼定
  • 金鸡尼丁
  • 类金鸡纳碱
  • 辛可尼汀
  • 金鸡纳啶
  • (-)-辛可尼
  • Cinchonidine 辛可尼定
  • 金鸡纳啶(RG)
  • 辛可尼
  • 辛可尼丁 类金鸡纳碱
  • 辛可尼丁,cinchonidine,植物提取物,标准品,对照品
  • 辛可宁丁
  • (9S)-6'-甲氧基辛可宁-9-醇, 4-喹啉基-(5-乙烯基-1-氮杂双环[2.2.2]辛烷-2-基)甲醇
  • 辛可尼啶
  • 辛可尼丁(分析标准品)
- 英文别名 -
  • (8alpha,9r)-cinchonan-9-ol
  • ALPHA-QUINIDINE
  • A-QUINIDINE
  • CINCHONAN-9-OL,(8,9R)-
  • (-)-CINCHONIDINE
  • CINCHONIDINE
  • L-CINCHONIDINE
  • (8-alpha,9r)-cinchonan-9-o
  • (8alpha,9theta)-cinchonan-9-o
  • (8s,9r)-cinchonidine
  • 2-Quinuclidinemethanol, alpha-4-quinolyl-5-vinyl-
  • Cinchonan-9-ol
  • Cinchonan-9-ol, (8alpha,9R)-
  • Cinchovatine
  • CINCHONIDINE: CINCHONAN-9-OL,(8,9R)-,
  • [8α,9R]-Cinchonan-9-ol
  • CINCHONIDINE(RG)
  • Cinchonan-9-ol, (8α,9R)-
  • (+)-cinchonine
  • 1-Cinchonidine
  • chinchonidine
  • Cinchondine
  • 4-Quinolyl-(5-vinyl-1-azabicyclo[2.2.2]oct-2-yl)methanol
  • (8S,9R)-cinchonan-9-ol
  • 1U622LRA8Z
  • Cinchonan-9-ol, (8a,9R)-
  • (8-alpha,9R)-Cinchonan-9-ol
  • Cinchonan-9-ol, (8.alpha.,9R)-
  • (8alpha,9R)Cinchonan-9-ol
  • (R)-[(4S,5S,7S)-5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl]-quinolin-4-ylmethanol
  • AI3-1
  • α-Quinidine
  • alpha-Quinidine
  • (8alpha,9R)-Cinchonan-9-ol
  • L-Cinchonidine
  • Cinchonidine
  • Cinchonidine,98%
  • FT-0623823
  • CS-0267207
  • F0001-1271
  • Z104474148
  • CHEMBL15134
  • SCHEMBL732494
  • MLS006011421
  • VS-03255
  • SB40649
  • 1071759-34-6
  • .alpha.-Quinidine
  • CHEBI:183479
  • MLS002637808
  • GNF-PF-5411
  • KMPWYEUPVWOPIM-UHFFFAOYSA-N
  • (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol
  • AKOS000118852
  • NS00010165
  • WLN: T66 BNJ EYQ- DT66 A B CNTJ A1U1
  • NSC6176
  • (8.alpha.,9R)-Cinchonan-9-ol
  • alpha -quinidine
  • AKOS022060412
  • {5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl}(quinolin-4-yl)methanol
  • SY011344
  • AB00973495-02
  • (8alpha ,9R)-Cinchonan-9-ol
  • CCG-245136
  • Cinchonan-9-ol, (8alpha ,9R)-
  • 118-10-5
  • NCGC00094864-01
  • FT-0665046
  • Cinchonan-9-ol,9R)-
  • FT-0658646
  • 4-QUINOLYL(5-VINYL-1-AZABICYCLO[2.2.2]OCT-2-YL)METHANOL
  • HMS3369H22
  • BCP18343
  • SMR001488502
  • NCGC00094864-03
  • a-quinidine
  • HMS3372L22
  • (S)-Quinolin-4-yl[(1S,2R,4S,5R)-5-vinylquinuclidin-2-yl]methanol
  • NCGC00094864-04
  • 9-epi-Cinchonidine
  • Cinchonan-9-ol, (8alpha 9R)-
  • cinchonine
  • FT-0665045
  • FT-0627743
  • EN300-19538
  • nchem.180-comp1b
  • NCGC00094864-02
  • 2-Quinuclidinemethanol, .alpha.-4-quinolyl-5-vinyl-
  • SY010860
  • NSC5364
  • (+)-Cinchonine
  • D-Cinchonine
  • (8a,9R)-Cinchonan-9-ol, 9CI
  • NS00076878
  • quinolin-4-yl(5-vinylquinuclidin-2-yl)methanol
  • NS00100765
  • MLS002153905
  • KBio2_001645
  • SR-05000001575-6
  • Cinchonidine,(S)
  • Prestwick_66
  • Cinchonidine, 96%
  • Cinchonidine, purum, >=98.0% (dried material, NT)
  • AKOS016008633
  • QUININE SULFATE IMPURITY B [WHO-IP]
  • 485-71-2 (free base)
  • Q412713
  • SBI-0051617.P002
  • KBio1_000501
  • NSC-757800
  • (-) cinchonidine
  • HY-N0173
  • AI3-15317
  • SPBio_000937
  • (R)-((2S,4S,5R)-5-ETHENYL-1-AZABICYCLO(2.2.2)OCT-2-YL)(QUINOLIN-4-YL)METHANOL [WHO-IP]
  • (-)-Cinchonidine, 99% (total base), may cont. up to 5% quinine
  • CINCHONIDINE [WHO-IP]
  • (R)-quinolin-4-yl((2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol
  • Spectrum3_001745
  • CS-0007887
  • MFCD00006783
  • NCGC00262526-04
  • (-)-Cinchonidine, analytical standard
  • NSC 5364
  • Spectrum2_000719
  • NCGC00178057-01
  • QUININE HYDROCHLORIDE IMPURITY B [EP IMPURITY]
  • DTXSID60883396
  • EINECS 207-622-3
  • A-Quinidine
  • AB00052182_03
  • SPECTRUM1500839
  • TCMDC-123934
  • KBio2_006781
  • BSPBio_003450
  • (-)-Cinchonidine
  • (R)-4-quinolyl-[(2S,4S,5R)-5-vinylquinuclidin-2-yl]methanol
  • SDCCGMLS-0066969.P001
  • QUININE SULFATE IMPURITY B [EP IMPURITY]
  • SR-05000001575-1
  • BRD-K39079086-001-05-0
  • KMPWYEUPVWOPIM-KODHJQJWSA-N
  • (1R)-quinolin-4-yl((2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol
  • (R)-quinolin-4-yl((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol
  • SR-05000001575-7
  • BSPBio_000512
  • KBio2_004213
  • HMS2096J14
  • -Quinidine
  • CCG-36455
  • HMS2092M14
  • HMS1921K14
  • CINCHONIDINE [WHO-DD]
  • Pharmakon1600-01500839
  • UNII-1U622LRA8Z
  • Spectrum5_002073
  • NSC-5364
  • HMS2235F22
  • (S)-[(2R,4R,5S)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
  • IDI1_000501
  • Spectrum4_001173
  • NSC757800
  • HMS501J03
  • CCG-37735
  • (-)cinchonidine
  • SCHEMBL159532
  • (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methanol
  • Z1954806302
  • QUININE BISULFATE HEPTAHYDRATE IMPURITY B [WHO-IP]
  • NINDS_000501
  • SR-05000001575-8
  • (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
  • F15420
  • BRD-K17661460-001-04-0
  • KBioSS_001645
  • 485-71-2
  • Cinchovatine-
  • KBio3_002670
  • STR04708
  • CINCHONIDINE [MI]
  • (8S,9R)-Cinchonidine
  • NCGC00178057-02
  • CHEMBL533841
  • BRD-K17661460-001-03-2
  • SR-05000001575
  • SMR001233254
  • EN300-708682
  • KBioGR_001805
  • CHEBI:3703
  • BRD-K39079086-001-07-6
  • DivK1c_000501
  • BPBio1_000564
  • Cinchonan-9-ol, (8-alpha,9R)-
  • QUININE BISULFATE IMPURITY B [WHO-IP]
  • Spectrum_001165
  • Prestwick3_000606
  • Cinchonan-9-ol, (8a alpha,9R)-
物化性质
实验特性
LogP 3.10250
PSA 36.36000
Merck 2286
折射率 -107.5 ° (C=1, EtOH)
水溶性 不溶
沸点 464.5°C at 760 mmHg
熔点 204-206 ºC
闪点 234.7 °C
溶解度 0.25g/l
颜色与性状 白色斜方片状或棱形结晶
PH值 9 (0.2g/l, H2O, 20℃)
稳定性 Stable, but light-sensitive. Incompatible with strong oxidizing agents.
溶解性 难溶于水
敏感性 Light Sensitive
酸度系数(pKa) 5.80, 10.03(at 25℃)
比旋光度 -115 º (c=1, EtOH)
密度 1.0863 (rough estimate)
计算特性
精确分子量 294.17300
氢键供体数量 1
氢键受体数量 3
可旋转化学键数量 3
同位素质量 294.173
重原子数量 22
复杂度 412
同位素原子数量 0
确定原子立构中心数量 4
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 2.7
互变异构体数量 未确定
表面电荷 0
拓扑分子极性表面积 36.4
国际标准相关数据
EINECS 5364
海关数据
海关编码 2939200000
海关数据

中国海关编码:

2939200000
相关文献
专业数据库参考
PubChemId 24856544
参考资料
Reaxys RN 5286475
Beilstein 23,420
化合物详情(旧版)

辛可尼丁物理化学性质

【熔点 】204-206 °C(lit.)

【比旋光度 】-115 º (c=1, EtOH)

【折射率 】-107.5 ° (C=1, EtOH)

【水溶解性 】Insoluble

【敏感性 】Light Sensitive

Merck 14,2286

BRN 89690

【存储注意事项】光敏感

辛可尼丁产品用途


应用领域



化学品安全说明书(MSDS)


储运特性


扩展阅读
金鸡纳啶 http://www.biopurify.cn/p-2452.html
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