基本描述

别名	辛可尼丁 \| (9S)-6'-甲氧基辛可宁-9-醇
英文别名	BRD-K17661460-001-04-0 \| BRD-K39079086-001-05-0 \| IDI1_000501 \| AKOS016008633 \| HY-N0173 \| KBio2_006781 \| KBioGR_001805 \| PDSP2_000142 \| (R)-quinolin-4-yl((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol \| SDCCGMLS-0066969.P001 \| Spectrum5_000964 \| QUININE
规格或纯度	≥98%
英文名称	Cinchonidine
生化机理	奎宁类似物。溶溶剂。抑制恶性疟原虫。干扰铁原卟啉的形成。SERT抑制剂弱。在体内显示出抗疟作用。口服具有活性
储存温度	避光
运输条件	常规运输
备注	如果有可能，您尽量在使用的当天配置溶液，并在当天使用完它。但是，如果您需要预先配制储备溶液，我们建议您将溶液等份保存在-20°C的密封小瓶中。通常，它们最多可以使用一个月。在使用前和打开样品瓶之前，我们建议您让您的产品在室温下平衡至少1小时。需要更多关于溶解度，用法和处理的建议吗？请访问我们的常见问题（FAQ）页面以获取更多详细信息。
产品介绍	application： It finds its uses as an antimalarial compound. It is a lysosomotropic agent, inhibits Plasmodium falciparum, interferes with ferriprotoporphyrin formation and is a weak SERT inhibitor.

AI解读

关联靶点（人）

ACHE Tclin Acetylcholinesterase (18204 活性数据)

点击查看靶蛋白信息： ACHE

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC2A1 Tchem Glucose transporter (14755 活性数据)

点击查看靶蛋白信息： SLC2A1

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

WI-38 (2654 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HepG2 (196354 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

POLI Tchem DNA polymerase iota (116820 活性数据)

点击查看靶蛋白信息： POLI

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 活性数据)

点击查看靶蛋白信息： TDP1

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 活性数据)

点击查看靶蛋白信息： SLCO1B1

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CBX1 Tbio Chromobox protein homolog 1 (92434 活性数据)

点击查看靶蛋白信息： CBX1

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 活性数据)

点击查看靶蛋白信息： SLCO1B3

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

关联靶点（其它种属）

ampC Beta-lactamase AmpC (62480 活性数据)

点击查看靶蛋白信息： ampC

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Hdac6 Histone deacetylase 6 (222 活性数据)

点击查看靶蛋白信息： Hdac6

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Trypanosoma brucei brucei (13300 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Plasmodium falciparum (966862 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ht1 Hexose transporter 1 (14071 活性数据)

点击查看靶蛋白信息： ht1

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 活性数据)

点击查看靶蛋白信息： rep

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

BCHE Cholinesterase (8742 活性数据)

点击查看靶蛋白信息： BCHE

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Leishmania mexicana mexicana (27 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SARS-CoV-2 (38078 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用机制

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

名称和识别符

PubChem SID	488187274
EC号	207-622-3
分子类型	小分子
IUPAC Name	(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
INCHI	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
InChi Key	KMPWYEUPVWOPIM-KODHJQJWSA-N
Canonical SMILES	C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O
Isomeric SMILES	C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=CC=NC4=CC=CC=C34)O
WGK Germany	3
RTECS	GD2975000
PubChem CID	101744
分子量	294.39
Beilstein号	89690
Reaxy-Rn	5286475

化学和物理性质

溶解性	不溶于水；可溶于乙醇、乙醚、氯仿
密度	1.2
敏感性	对光敏感
比旋光度	-107.5 ° (C=1, EtOH)
熔点	204-206°C
分子量	294.400 g/mol
XLogP3	2.700
氢键供体数Hydrogen Bond Donor Count	1
氢键受体数Hydrogen Bond Acceptor Count	3
可旋转键计数Rotatable Bond Count	3
精确质量Exact Mass	294.173 Da
单同位素质量Monoisotopic Mass	294.173 Da
拓扑极表面积Topological Polar Surface Area	36.400 Å²
重原子数Heavy Atom Count	22
形式电荷Formal Charge	0
复杂度Complexity	412.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	4
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1

安全和危险性（GHS）

象形图	GHS08, GHS07
信号词	Warning
危险声明	H373: 通过长时间或反复暴露对器官造成损害 H302: 吞食有害 H317: 可能引起皮肤过敏反应 H361: 怀疑破坏生育力或未出生的孩子
预防措施声明	P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾 P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P302+P352: 如皮肤沾染：用水充分清洗。 P321: 特殊处理（请参阅此标签上的...）。 P405: 密闭存放 P501: 将内容物/容器处理到。。。 P264: 处理后要彻底洗手。 P260: 不要吸入灰尘/烟雾/气体/雾/蒸汽/喷雾。 P270: 使用本产品时，请勿进食、饮水或吸烟。 P272: 被污染的工作服不允许离开工作场所 P333+P313: 如发生皮肤刺激或皮疹：求医/就诊。 P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。 P330: 漱口 P203: 使用前，获取、阅读并遵守所有安全说明。 P301+P317: 如果被吞咽：请寻求医疗帮助。 P318: 如果暴露或担心，请就医。 P319: 如果你感到不适，请寻求医疗帮助。
WGK Germany	3
RTECS	GD2975000
Reaxy-Rn	5286475
Merck Index	2286
个人防护装备	Eyeshields,Faceshields,Gloves,type N95 (US),type P1 (EN143) respirator filter

技术规格说明书

Purity(Titration by HClO4)(calcd.on anh.substance)	97.5-102.5（%）
Melting point	198-202（℃）
Loss on drying	0-1（%）
Ignition Residue (as sulfate)	0-0.1（%）
Specific Rotation [a]20/D(c=1 in EtOH)	-115--105（°）
Appearance（C109632)	White to Off-White Powder or Crystals
NMR Spectrum 1H	Conforms to structure

技术规格说明书

质检证书（CoA,COO,BSE/TSE 和分析图谱)

C of A & Other Certificates(BSE/TSE, COO):

输入批号以搜索分析图谱:

通过匹配包装上的批号来查找并下载产品的 COA，每批产品都进行了严格的验证，您可放心使用！

找到10个结果

批号(Lot Number)	证书类型	日期	货号
D2410264	分析证书	24-03-20	C109632
C23211017	分析证书	22-07-15	C109632
C2426022	分析证书	22-07-15	C109632
D2423057	分析证书	22-07-15	C109632
J2211779	分析证书	22-07-15	C109632
J2211843	分析证书	22-07-15	C109632
J2211859	分析证书	22-07-15	C109632
J2211921	分析证书	22-07-15	C109632
D1816118	分析证书	22-02-22	C109632
D1816119	分析证书	22-02-22	C109632

此产品的引用文献

如何在您的发表作品中引用阿拉丁的产品和网站?

1. Huan Xue, Hao-Jie Xing, Bin Wang, Chao Fu, Yu-Shan Zhang, Xi Qiao, Chao Guo, Xiao-Li Zhang, Bin Hu, Xin Zhao, Li-Jiao Deng, Xiao-Chan Zhu, Yi Zhang, Yun-Feng Liu. (2023) Cinchonine, a Potential Oral Small-Molecule Glucagon-Like Peptide-1 Receptor Agonist, Lowers Blood Glucose and Ameliorates Non-Alcoholic Steatohepatitis. Drug Design Development and Therapy, [PMID:37197367] [10.2147/DDDT.S404055]
2. Zhi-Yuan Zhang, Li-Li Rui, Ya-Li Lin, Hui-Dan Zhang, Ji-Ming Ou, Jian-Feng He, Quan-Zhou Wu. (2021) Preparation of ordered macroporous molecularly imprinted polymers and their applications in purifying cinchona alkaloids from cinchona extract. POLYMER INTERNATIONAL, 70 (9): (1344-1355). [10.1002/pi.6205]
3. Yuan Tan, Lijing Jing, Yonghong Ding, Tianxin Wei. (2015) A novel double-layer molecularly imprinted polymer film based surface plasmon resonance for determination of testosterone in aqueous media. APPLIED SURFACE SCIENCE, 342 (84). [10.1016/j.apsusc.2015.03.031]
4. Li Liu, Xuecai Tan, Xiaoxue Fang, Yuexin Sun, Fuhou Lei, Zaiyin Huang. (2012) Electrochemical Sensor Based on Molecularly Imprinted Polymer Film Prepared with Functional Abietic-Type Acids as Cross-Linker for the Determination of Quinine. ELECTROANALYSIS, 24 (7): (1647-1654). [10.1002/elan.201200085]

参考文献

1. K Itoh,M Yamamura,S Muramatsu,K Hoshino,A Masubuchi,T Sasaki,Y Tanaka. (2005-09-30) Stereospecific oxidation of the (S)-enantiomer of RS-8359, a selective and reversible monoamine oxidase A (MAO-A) inhibitor, by aldehyde oxidase.. Xenobiotica; the fate of foreign compounds in biological systems, 35 ((6)): (561-573). [PMID:16192108]
2. Toshifumi Takeuchi,Takashi Mukawa,Hideyuki Shinmori. (2005-10-08) Signaling molecularly imprinted polymers: molecular recognition-based sensing materials.. Chemical record (New York, N.Y.), 5 ((5)): (263-275). [PMID:16211586]
3. György Szöllösi,Abhijit Chatterjee,Péter Forgó,Mihály Bartók,Fujio Mizukami. (2006-07-15) Structure-property relationship in py-hexahydrocinchonidine diastereomers: ab initio and NMR study.. The journal of physical chemistry. A, 109 ((5)): (860-868). [PMID:16838957]
4. Ryan A Olsen,Dan Borchardt,Larry Mink,Arun Agarwal,Leonard J Mueller,Francisco Zaera. (2006-12-07) Effect of protonation on the conformation of cinchonidine.. Journal of the American Chemical Society, 128 ((49)): (15594-15595). [PMID:17147361]
5. Karol M Kacprzak,Wolfgang Lindner,Norbert M Maier. (2007-09-14) An improved synthesis of 10,11-didehydro Cinchona alkaloids.. Chirality, 20 ((3-4)): (441-445). [PMID:17853397]
6. Jonas Nyhlén,Lars Eriksson,Jan-E Bäckvall. (2007-10-30) Synthesis and optical resolution of an allenoic acid by diastereomeric salt formation induced by chiral alkaloids.. Chirality, 20 ((1)): (47-50). [PMID:17966123]
7. Chun-Yin Zhu,Xian-Ming Deng,Xiu-Li Sun,Jun-Cheng Zheng,Yong Tang. (2008-05-16) Highly enantioselective synthesis of isoxazoline N-oxides.. Chemical communications (Cambridge, England), ((6)): (738-740). [PMID:18478708]
8. Atsushi Urakawa,Daniel M Meier,Heinz Rüegger,Alfons Baiker. (2008-07-19) Conformational behavior of cinchonidine revisited: a combined theoretical and experimental study.. The journal of physical chemistry. A, 112 ((31)): (7250-7255). [PMID:18636698]
9. Jian Zhang,Shumei Chen,Tao Wu,Pingyun Feng,Xianhui Bu. (2008-09-09) Homochiral crystallization of microporous framework materials from achiral precursors by chiral catalysis.. Journal of the American Chemical Society, 130 ((39)): (12882-12883). [PMID:18774816]
10. Erik Schmidt,Wolfgang Kleist,Frank Krumeich,Tamas Mallat,Alfons Baiker. (2009-12-30) Platinum nanoparticles: the crucial role of crystal face and colloid stabilizer in the diastereoselective hydrogenation of cinchonidine.. Chemistry (Weinheim an der Bergstrasse, Germany), 16 ((7)): (2181-2192). [PMID:20039346]
11. Yueqi Liu,Kaori Hoshina,Jun Haginaka. (2010-02-16) Monodispersed, molecularly imprinted polymers for cinchonidine by precipitation polymerization.. Talanta, 80 ((5)): (1713-1718). [PMID:20152401]
12. Sarfraz A Nawaz,Muhammad Ayaz,Wolfgang Brandt,Ludger A Wessjohann,Bernhard Westermann. (2010-12-28) Cation-π and π-π stacking interactions allow selective inhibition of butyrylcholinesterase by modified quinine and cinchonidine alkaloids.. Biochemical and biophysical research communications, 404 ((4)): (935-940). [PMID:21185266]
13. Roman Büttiker,Jürgen Ebert,Christian Hinderling,Christian Adlhart. (2011-05-03) Membranes for specific adsorption: immobilizing molecularly imprinted polymer microspheres using electrospun nanofibers.. Chimia, 65 ((3)): (182-186). [PMID:21528654]
14. Zbigniew Karczmarzyk,Teodozja M Lipińska,Waldemar Wysocki,Monika Denisiuk,Katarzyna Piechocka. (2011-09-02) Tosyl esters of cinchonidine and cinchonine alkaloids: the structure-reactivity relationship in the hydrolysis to 9-epibases.. Acta crystallographica. Section C, Crystal structure communications, 67 ((Pt 9)): (o346-o349). [PMID:21881184]
15. Nobutaka Maeda,Konrad Hungerbühler,Alfons Baiker. (2011-11-17) Asymmetric hydrogenation on chirally modified Pt: origin of hydrogen in the N-H-O interaction between cinchonidine and ketone.. Journal of the American Chemical Society, 133 ((49)): (19567-19569). [PMID:22084835]
16. Pierrick Nun,Violaine Pérez,Monique Calmès,Jean Martinez,Frédéric Lamaty. (2012-02-11) Preparation of chiral amino esters by asymmetric phase-transfer catalyzed alkylations of Schiff bases in a ball mill.. Chemistry (Weinheim an der Bergstrasse, Germany), 18 ((12)): (3773-3779). [PMID:22322525]
17. Arkajyoti Sengupta,Raghavan B Sunoj. (2012-11-17) Mechanistic insights on organocatalytic enantioselective decarboxylative protonation by epicinchona-thiourea hybrid derivatives.. The Journal of organic chemistry, 77 ((23)): (10525-10536). [PMID:23153357]
18. Fumihiko Kitagawa,Hiroshi Sudaki,Kenji Sueyoshi,Koji Otsuka. (2013-01-11) Open-tubular electrochromatographic chiral separation of amino acids using an organic nanocrystals immobilized capillary.. Analytical sciences : the international journal of the Japan Society for Analytical Chemistry, 29 ((1)): (107-112). [PMID:23303094]
19. Matthew L Beckman,Akula Bala Pramod,Danielle Perley,L Keith Henry. (2013-10-29) Stereoselective inhibition of serotonin transporters by antimalarial compounds.. Neurochemistry international, 73 (98-106). [PMID:24161619]
20. Oleg V Larionov,David Stephens,Adelphe Mfuh,Gabriel Chavez. (2014-01-15) Direct, catalytic, and regioselective synthesis of 2-alkyl-, aryl-, and alkenyl-substituted N-heterocycles from N-oxides.. Organic letters, 16 ((3)): (864-867). [PMID:24410049]
21. Angelo Vargas,Norberto Bonalumi,Davide Ferri,Alfons Baiker. (2006-01-20) Solvent-induced conformational changes of O-phenyl-cinchonidine: a theoretical and VCD spectroscopy study.. The journal of physical chemistry. A, 110 ((3)): (1118-1127). [PMID:16420016]
22. Simon Diezi,Davide Ferri,Angelo Vargas,Tamas Mallat,Alfons Baiker. (2006-03-23) The origin of chemo- and enantioselectivity in the hydrogenation of diketones on platinum.. Journal of the American Chemical Society, 128 ((12)): (4048-4057). [PMID:16551114]
23. Erik Schmidt,Davide Ferri,Alfons Baiker. (2007-06-23) Surface processes occurring on Rh/alumina during chiral modification by cinchonidine: an ATR-IR spectroscopy study.. Langmuir : the ACS journal of surfaces and colloids, 23 ((15)): (8087-8093). [PMID:17583922]
24. Kensuke Fukiya,Kunio Itoh,Satoshi Yamaguchi,Akiko Kishiba,Mayuko Adachi,Nobuaki Watanabe,Yorihisa Tanaka. (2009-11-17) A single amino acid substitution confers high cinchonidine oxidation activity comparable with that of rabbit to monkey aldehyde oxidase 1.. Drug metabolism and disposition: the biological fate of chemicals, 38 ((2)): (302-307). [PMID:19910515]
25. Ping Liu,Sun Liang,Ben-Jie Wang,Rui-Chen Guo. (2010-02-20) Construction of expression system of rabbit aldehyde oxidase cDNA for the clarification of species differences.. European journal of drug metabolism and pharmacokinetics, 34 ((3-4)): (205-211). [PMID:20166440]
26. Sonia Keunchkarian,Jaiver Osorio Grisales,Juan M Padró,Susana Boeris,Cecilia B Castells. (2012-05-11) Development of a chiral stationary phase based on cinchonidine. Comparison with a quinine-based chiral column.. Chirality, 24 ((7)): (512-518). [PMID:22573362]
27. Naoki Haraguchi,Parbhej Ahamed,Md Masud Parvez,Shinichi Itsuno. (2012-06-21) Synthesis of main-chain chiral quaternary ammonium polymers for asymmetric catalysis using quaternization polymerization.. Molecules (Basel, Switzerland), 17 ((6)): (7569-7583). [PMID:22713348]
28. Nicholas G Spiropulos,Jennifer M Heemstra. (2013-02-02) Templating effect in DNA proximity ligation enables use of non-bioorthogonal chemistry in biological fluids.. Artificial DNA, PNA & XNA, 3 ((3)): (123-128). [PMID:23370267]
29. Neng-jun Zhong,Li Liu,Dong Wang,Yong-Jun Chen. (2013-03-28) Enantioselective tandem reaction of chromone-derived Morita-Baylis-Hillman carbonates with benzylamines catalyzed by a trifunctional organocatalyst: the synthesis of chiral 3-aminomethylene-flavanones.. Chemical communications (Cambridge, England), 49 ((35)): (3697-3699). [PMID:23532090]
30. Huan Xue, Hao-Jie Xing, Bin Wang, Chao Fu, Yu-Shan Zhang, Xi Qiao, Chao Guo, Xiao-Li Zhang, Bin Hu, Xin Zhao, Li-Jiao Deng, Xiao-Chan Zhu, Yi Zhang, Yun-Feng Liu. (2023) Cinchonine, a Potential Oral Small-Molecule Glucagon-Like Peptide-1 Receptor Agonist, Lowers Blood Glucose and Ameliorates Non-Alcoholic Steatohepatitis. Drug Design Development and Therapy, [PMID:37197367] [10.2147/DDDT.S404055]
31. Zhi-Yuan Zhang, Li-Li Rui, Ya-Li Lin, Hui-Dan Zhang, Ji-Ming Ou, Jian-Feng He, Quan-Zhou Wu. (2021) Preparation of ordered macroporous molecularly imprinted polymers and their applications in purifying cinchona alkaloids from cinchona extract. POLYMER INTERNATIONAL, 70 (9): (1344-1355). [10.1002/pi.6205]
32. Yuan Tan, Lijing Jing, Yonghong Ding, Tianxin Wei. (2015) A novel double-layer molecularly imprinted polymer film based surface plasmon resonance for determination of testosterone in aqueous media. APPLIED SURFACE SCIENCE, 342 (84). [10.1016/j.apsusc.2015.03.031]
33. Li Liu, Xuecai Tan, Xiaoxue Fang, Yuexin Sun, Fuhou Lei, Zaiyin Huang. (2012) Electrochemical Sensor Based on Molecularly Imprinted Polymer Film Prepared with Functional Abietic-Type Acids as Cross-Linker for the Determination of Quinine. ELECTROANALYSIS, 24 (7): (1647-1654). [10.1002/elan.201200085]

溶液计算器

摩尔浓度计算器

计算溶液所需的质量、体积或浓度。

质量

=

浓度

x

体积

x

分子量

g/mol

稀释计算器

计算配制储备溶液所需的稀释度。

浓度1（C1）

x

体积 1 (V1)

=

浓度 2 (C2)

x

体积 2 (V2)

复溶计算器

复溶计算器允许您快速计算试剂的体积，以复溶小瓶。只需输入试剂的质量和目标浓度，计算器将确定其余部分。

体积（添加到小瓶中）

=

质量（小瓶）

÷

所需的复溶浓度

货号 (SKU)	包装规格	是否现货
C109632-1g	1g	现货
C109632-5g	5g	现货
C109632-25g	25g	期货
C109632-100g	100g	现货

辛可尼定

库存信息

库存信息

库存信息

库存信息

基本描述

AI解读

关联靶点（人）

关联靶点（其它种属）

作用机制

名称和识别符

化学和物理性质

安全和危险性（GHS）

技术规格说明书

质检证书（CoA,COO,BSE/TSE 和分析图谱)

相关文档

此产品的引用文献

参考文献

溶液计算器

摩尔浓度计算器

稀释计算器

复溶计算器