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牛磺胆酸, OATP1C1;钠/胆酸和硫酸化溶质共转运体 2 的抑制剂

一种胆甾类固醇,可用于定量共轭胆汁酸
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货号 (SKU) 包装规格 是否现货 价格 数量
T336942-5mg
5mg 现货 Stock Image
T336942-25mg
25mg 现货 Stock Image
T336942-100mg
100mg 现货 Stock Image
T336942-250mg
250mg 现货 Stock Image
T336942-1g
1g 期货 Stock Image

基本描述

英文别名 Cholic acid taurine conjugate | N-Choloyltaurine | N-choloyl-taurine | Cholaic acid | 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanic acid 24-taurine | Taurocholate | TAUROCHOLIC ACID | NSC25505 | NSC 25505 | Acidum cholatauricum | Cholyltaurine
规格或纯度 Moligand™, ≥98%
英文名称 Taurocholic Acid
储存温度 2-8°C储存,充氩
运输条件 冰袋运输
作用类型 抑制剂
作用机制 OATP1C1;钠/胆酸和硫酸化溶质共转运体 2 的抑制剂
产品介绍

牛磺胆酸是一种胆甾醇,已用于通过电喷雾电离质谱法对干血斑中的共轭胆汁酸进行定量。另外,其钠盐可以充当脂肪酶促进剂。

Taurocholic Acid is a choleretic steroid which has been used for the quantification of conjugated bile acids in dried blood spots using electrospray ionization-mass spectrometry. Additionally, its sodium salt can act as a lipase accelerator.

纯度 ≥98%

产品属性

pKa值 pKₐ: 1.42 (Predicted)
Ki Data Solute carrier organic anion transporter family member 1A1: Ki= 10.8 μM (rat); Solute carrier organic anion transporter family member 1A4: Ki= 39.4 μM (rat); Ileal bile acid transporter: Ki= 41.5 μM (human); Solute carrier organic anion transporter family
IC50 Plasmodium falciparum: IC₅₀= 3.16 μM; Bile acid transporter: IC₅₀= 5.3 μM (human); Bile acid transporter: IC₅₀= 6.0 μM (rat); Multidrug resistance associated protein: IC₅₀= 40.0 μM (human); Multidrug resistance-associated protein 4: IC₅₀= 250 μM (human)

关联靶点(人)

SLCO1C1 Tbio 溶质载体有机阴离子转运蛋白家族成员1C1(Solute carrier organic anion transporter family member 1C1) (0 活性数据)
活性类型 活性值-log(M) 作用机制 期刊 参考文献(PubMed IDs)
SLC10A2 Tclin 回肠钠/胆汁酸协同转运蛋白(Ileal sodium/bile acid cotransporter) (0 活性数据)
活性类型 活性值-log(M) 作用机制 期刊 参考文献(PubMed IDs)
NR3C1 Tclin Glucocorticoid receptor (14987 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC10A2 Tclin Ileal bile acid transporter (415 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Caco-2 (12174 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
GPBAR1 Tchem G-protein coupled bile acid receptor 1 (1723 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCG2 Tchem ATP-binding cassette sub-family G member 2 (4927 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC22A1 Tchem Solute carrier family 22 member 1 (646 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCC2 Tchem Canalicular multispecific organic anion transporter 1 (1191 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCB11 Tchem Bile salt export pump (2311 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCC3 Tbio Canalicular multispecific organic anion transporter 2 (718 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC22A8 Tclin Solute carrier family 22 member 8 (241 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO1A2 Tchem Solute carrier organic anion transporter family member 1A2 (104 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO2B1 Tchem Solute carrier organic anion transporter family member 2B1 (580 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCC4 Tchem Multidrug resistance-associated protein 4 (785 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLC22A7 Tbio Solute carrier family 22 member 7 (39 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MRP3 Multidrug resistance associated protein (78 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO4A1 Tbio Solute carrier organic anion transporter family member 4A1 (14 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO3A1 Tbio Solute carrier organic anion transporter family member 3A1 (19 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCC10 Tbio Multidrug resistance-associated protein 7 (31 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
ABCC11 Tbio ATP-binding cassette sub-family C member 11 (24 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID

关联靶点(其它种属)

PLA2G1B Phospholipase A2 group 1B (227 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Abcc1 Multidrug resistance-associated protein 1 (42 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Abcb1b P-glycoprotein 1 (174 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Hdac6 Histone deacetylase 6 (222 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Abcb1a P-glycoprotein 3 (492 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Pasteurella multocida (1166 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Hepatitis B virus (7925 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slc10a1 Bile acid transporter (65 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slc22a6 Solute carrier family 22 member 6 (141 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Mdr1a Multidrug resistance protein 1a (106 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1a1 Solute carrier organic anion transporter family member 1A1 (265 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1a4 Solute carrier organic anion transporter family member 1A4 (114 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1b2 Solute carrier organic anion transporter family member 1B2 (36 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slc10a2 Ileal sodium/bile acid cotransporter (17 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1c1 Solute carrier organic anion transporter family member 1C1 (11 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1a5 Solute carrier organic anion transporter family member 1A5 (48 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slco1a3 Solute carrier organic anion transporter family member 1A3 (65 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slc10a1 Sodium/bile acid cotransporter (19 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Slc51a Organic solute transporter subunit alpha (6 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SLCO1A2 Solute carrier organic anion transporter family member (21 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
SARS-CoV-2 (38078 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 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 504751152
EC号 201-336-2, 804-788-4
分子类型 小分子
IIUPAC Name 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
INCHI 1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1
InChi Key WBWWGRHZICKQGZ-HZAMXZRMSA-N
Smiles CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Isomeric SMILES C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
关联CAS 81-24-3,345909-26-4,145-42-6 (mono-hydrochloride salt)
PubChem CID 6675
NSC Number 25505
MeSH Entry Terms Cholyltaurine;Sodium Taurocholate;Taurine Cholate;Taurocholate;Taurocholate Sodium;Taurocholate, Sodium;Taurocholic Acid;Taurocholic Acid, (5 alpha)-Isomer;Taurocholic Acid, (7 beta)-Isomer;Taurocholic Acid, Monolithium Salt;Taurocholic Acid, Monosodium S
分子量 515.7

化学和物理性质

溶解性 Soluble in water, hot alcohol, ethyl acetate (slightly), and ether.
密度 ~1.3 g/cm3(Predicted)
敏感性 易吸潮
折光率 n20D1.57 (Predicted)
比旋光度 α18/D +38.8°, c = 0.002 in alcohol
熔点 125° C
分子量 515.700 g/mol
XLogP3 2.200
氢键供体数Hydrogen Bond Donor Count 5
氢键受体数Hydrogen Bond Acceptor Count 7
可旋转键计数Rotatable Bond Count 7
精确质量Exact Mass 515.292 Da
单同位素质量Monoisotopic Mass 515.292 Da
拓扑极表面积Topological Polar Surface Area 153.000 Ų
重原子数Heavy Atom Count 35
形式电荷Formal Charge 0
复杂度Complexity 891.000
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 11
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 GHS07
信号词 警告
危险声明

H315: 引起皮肤刺激

H319: 引起严重眼睛刺激

H335: 可能引起呼吸道刺激

预防措施声明

P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾

P264: 处理后要彻底洗手。

P271: 仅在室外或通风良好的地方使用。

P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。

P321: 特殊处理(请参阅此标签上的...)。

P302+P352: 如皮肤沾染:用水充分清洗。

P304+P340: 如误吸入:将人转移到空气新鲜处,保持呼吸舒适体位。

P305+P351+P338: 如进入眼睛:用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出,取出隐形眼镜。继续冲洗。

P362+P364: 脱掉沾污的衣服,清洗后方可重新使用。

P405: 密闭存放

P403+P233: 存放在通风良好的地方。保持容器密闭。

P501: 将内容物/容器处理到。。。

P264+P265: 处理后彻底洗手[和…]。不要触摸眼睛。

P337+P317: 如果眼睛刺激持续:寻求医疗帮助。

P332+P317: 如果出现皮肤刺激:请寻求医疗帮助。

P319: 如果你感到不适,请寻求医疗帮助。

Merck Index 6.88541666666667

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批号(Lot Number) 证书类型 货号
A2303658 分析证书 T336942
A2303460 分析证书 T336942
A2303459 分析证书 T336942
A2303453 分析证书 T336942
F2513098 分析证书 T336942
K2428610 分析证书 T336942
K2428611 分析证书 T336942
K2428612 分析证书 T336942
K2428613 分析证书 T336942
E2512096 分析证书 T336942
I2523030 分析证书 T336942
G2518090 分析证书 T336942
A2303452 分析证书 T336942
J2309019 分析证书 T336942
C2404195 分析证书 T336942
B2426170 分析证书 T336942
A2431243 分析证书 T336942

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1. Wei Jia, Jiying Zhu.  (2023)  Molecular Mechanism of ε-Polylysine Treatment of Animal-Derived Foods: Glycine Amidinotransferase Activity Implicates Upregulation of l-Arginine and Creatine.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,  71  (41): (15106–15120).  [PMID:37793042] [10.1021/acs.jafc.3c04033]
2. Zihang Yuan, Jie Wang, Haoran Zhang, Yuanyuan Chai, Yunxia Xu, Yingying Miao, Ziqiao Yuan, Luyong Zhang, Zhenzhou Jiang, Qinwei Yu.  (2023)  Glycocholic acid aggravates liver fibrosis by promoting the up-regulation of connective tissue growth factor in hepatocytes.  CELLULAR SIGNALLING,  101  (110508).  [PMID:36341984] [10.1016/j.cellsig.2022.110508]
3. Wei Xu, Yingying Kong, Tuo Zhang, Zhihua Gong, Wenjun Xiao.  (2022)  L-Theanine regulates lipid metabolism by modulating gut microbiota and bile acid metabolism.  JOURNAL OF THE SCIENCE OF FOOD AND AGRICULTURE,  103  (3): (1283-1293).  [PMID:36087337] [10.1002/jsfa.12222]
4. Tao Wang, Junjie Han, Huanqin Dai, Jingzu Sun, Jinwei Ren, Wenzhao Wang, Shanshan Qiao, Chang Liu, Li Sun, Shuangjiang Liu, Dianpeng Li, Shenglong Wei, Hongwei Liu.  (2022)  Polysaccharides from Lyophyllum decastes reduce obesity by altering gut microbiota and increasing energy expenditure.  CARBOHYDRATE POLYMERS,  295  (119862).  [PMID:35989006] [10.1016/j.carbpol.2022.119862]
5. Ma Wen, Yang Bingxin, Li Jun, Liu Mingxia, Li Xianjiang, Liu Huwei.  (2022)  Maltose-functional metal–organic framework assisted laser desorption/ionization mass spectrometry for small biomolecule determination.  MICROCHIMICA ACTA,  189  (7): (1-8).  [PMID:35689150] [10.1007/s00604-022-05338-x]
6. Xiaoxu Cheng, Zifeng Pi, Zhong Zheng, Shu Liu, Fengrui Song, Zhiqiang Liu.  (2022)  Combined 16S rRNA gene sequencing and metabolomics to investigate the protective effects of Wu-tou decoction on rheumatoid arthritis in rats.  JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES,  1199  (123249).  [PMID:35447521] [10.1016/j.jchromb.2022.123249]
7. Chen Lirong, Guo Yuqiu, Li Xiaoyue, Gong Kuijie, Liu Kaichang.  (2021)  Phenolics and related in vitro functional activities of different varieties of fresh waxy corn: a whole grain.  BMC Chemistry,  15  (1): (1-9).  [PMID:33648574] [10.1186/s13065-021-00740-7]
8. Yufei Sun, Zhiqiang Liu, Zifeng Pi, Fengrui Song, Jianlin Wu, Shu Liu.  (2021)  Poria cocos could ameliorate cognitive dysfunction in APP/PS1 mice by restoring imbalance of Aβ production and clearance and gut microbiota dysbiosis.  PHYTOTHERAPY RESEARCH,  35  (5): (2678-2690).  [PMID:33432644] [10.1002/ptr.7014]
9. Qiyi He, Huiyi Yang, Yingshan Chen, Ding Shen, Xiping Cui, Chunguo Zhang, Huanxin Xiao, Sergei A. Eremin, Yanxiong Fang, Suqing Zhao.  (2020)  Prussian blue nanoparticles with peroxidase-mimicking properties in a dual immunoassays for glycocholic acid.  JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS,  187  (113317).  [PMID:32416340] [10.1016/j.jpba.2020.113317]
10. Min Gu, Nan Bai, Trond M Kortner.  (2017)  Taurocholate supplementation attenuates the changes in growth performance, feed utilization, lipid digestion, liver abnormality and sterol metabolism in turbot (Scophthalmus maximus) fed high level of plant protein.  AQUACULTURE,  468  (597).  [10.1016/j.aquaculture.2016.11.022]
11. Guan-Lin Chen, Song-Gen Chen, Ying-Qing Xie, Fu Chen, Ying-Ying Zhao, Chun-Xia Luo, Yong-Qing Gao.  (2015)  Total phenolic, flavonoid and antioxidant activity of 23 edible flowers subjected to in vitro digestion.  Journal of Functional Foods,  17  (243).  [10.1016/j.jff.2015.05.028]
12. Shun Zhang, Ting Cai, Jing Lin, Jia-Juan Liu, Yong-Gang Zhao, Min-Yi Cao.  (2024)  Analysis of 15 bile acids in human plasma based on C18 functionalized magnetic organic polymer nanocomposite coupled with liquid chromatography-tandem mass spectrometry.  JOURNAL OF CHROMATOGRAPHY A,  1725  (464962).  [PMID:38704923] [10.1016/j.chroma.2024.464962]
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14. Tong Liu, Siqing Fan, Pengfei Meng, Mingxia Ma, Yanxin Wang, Jiaojiao Han, Yufei Wu, Xiao Li, Xiurong Su, Chenyang Lu.  (2024)  Dietary Dihydroquercetin Alleviated Colitis via the Short-Chain Fatty Acids/miR-10a-5p/PI3K-Akt Signaling Pathway.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,  72  (42): (23211-23223).  [PMID:39393822] [10.1021/acs.jafc.4c03278]
15. Qian Fang, Xiaoying Hou, Limei Fan, Yufei Deng, Xiaoxuan Li, Hongyun Zhang, Haiping Wang, Zhengqi Fu, Binlian Sun, Xiji Shu, Hongzhi Du, Yuchen Liu.  (2025)  Gut microbiota derived DCA enhances FOLFOX efficacy via Ugt1a6b mediated enterohepatic circulation in colon cancer.  PHARMACOLOGICAL RESEARCH,  213  (107636).  [PMID:39894186] [10.1016/j.phrs.2025.107636]
16. Wen Ma, Mingxia Liu, Mengling Tu, Gang Wang, Jun Li, Fen Liu, Jian Yang, Xianjiang Li.  (2024)  Novel multi-layered MXene as laser desorption ionization mass spectrometry matrix for rapid detection of small biomolecules.  CHEMICAL ENGINEERING JOURNAL,  500  (157466).  [10.1016/j.cej.2024.157466]
17. Lingzheng Lu, Conghui Shan, Difei Tong, Yingying Yu, Weixia Zhang, Xunyi Zhang, Yang Shu, Weifeng Li, Guangxu Liu, Wei Shi.  (2024)  Olfactory toxicity of tetrabromobisphenol A to the goldfish Carassius auratus.  JOURNAL OF HAZARDOUS MATERIALS,  479  (135661).  [PMID:39213767] [10.1016/j.jhazmat.2024.135661]
18. Te Yu, Yonggang Dai, Zifei Wang, Yang Gao, Qiong Wu.  (2025)  Ultrasound-induced modifications of Auricularia auricula polysaccharides: Implications for antioxidant and glucose-lowering activities.  Food Chemistry-X,  25  (102209).  [PMID:39974537] [10.1016/j.fochx.2025.102209]

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