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阿仑膦酸钠三水合物

骨吸收抑制剂
    级别和纯度:
  • 10mM in Water
  • CAS编号: 121268-17-5
  • 分子式: C4H12NaNO7P2·3H2O
  • 分子量: 325.12
  • PubChem编号: 23681107
有货

库存信息

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货号 (SKU) 包装规格 是否现货 价格 数量
A420924-1ml
1ml 现货 Stock Image

基本描述

别名 (4-氨基-1-羟基-1-膦酸基-丁基)-磷酸钠盐三水合物 | 4-氨基-1-羟基-1-膦酸丁酯,单钠, MK-217 | 阿屈膦酸盐 钠 三水合物
英文别名 121268-17-5 | Alendronate sodium trihydrate | Fosamax | Alendronate monosodium trihydrate | Alendronate sodium hydrate | Adronat | Alendros | Sodium alendronate | SODIUM ALENDRONATE TRIHYDRATE | 2UY4M2U3RA | CHEBI:2566 | Alendronic acid monosodium salt trihydrate | DTXSID7047801
规格或纯度 10mM in Water
英文名称 Alendronate sodium trihydrate
生化机理 阿仑膦酸钠三水合物是一种骨吸收抑制剂;二磷酸法尼酯合成酶抑制剂(IC50 = 460 nM);CD45 蛋白酪氨酸磷酸酶抑制剂。抑制法尼酰合成酶(IC50 = 460 nM)和异戊烯类生物合成途径。能够提高 TGF-β1 水平。在体内和体外均有活性。
储存温度 -80℃储存
运输条件 超低温冰袋运输
产品介绍

无臭无味。羟乙膦酸钠是一种骨吸收抑制剂;金合欢基二磷酸合成酶抑制剂 (farnesyl diphosphate synthase)(IC50 = 460 nM); CD45蛋白酪氨酸磷酸酯酶(protein tyrosine phosphatase )抑制剂。

It's odorless and tasteless.Alendronate sodium trihydrate is a bone resorption inhibitor, farnesyl diphosphate synthase inhibitor and CD45 protein tyrosine phosphatase inhibitor.

关联靶点(其它种属)

Rattus norvegicus (775804 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
RAW264.7 (28094 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
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

分子类型 小分子
IIUPAC Name sodium;(4-amino-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate;trihydrate
INCHI 1S/C4H13NO7P2.Na.3H2O/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;;;;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);;3*1H2/q;+1;;;/p-1
InChi Key DCSBSVSZJRSITC-UHFFFAOYSA-M
Smiles C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.O.O.O.[Na+]
Isomeric SMILES C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.O.O.O.[Na+]
分子量 325.12
Reaxy-Rn 13434693
Reaxys-RN link address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13434693&ln=

化学和物理性质

敏感性 对热敏感
分子量 325.120 g/mol
XLogP3
氢键供体数Hydrogen Bond Donor Count 8
氢键受体数Hydrogen Bond Acceptor Count 11
可旋转键计数Rotatable Bond Count 5
精确质量Exact Mass 325.03 Da
单同位素质量Monoisotopic Mass 325.03 Da
拓扑极表面积Topological Polar Surface Area 167.000 Ų
重原子数Heavy Atom Count 18
形式电荷Formal Charge 0
复杂度Complexity 293.000
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 0
未定义的原子立体中心计数Undefined Atom Stereocenter Count 1
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 5

安全和危险性(GHS)

象形图 GHS05,   GHS07,   GHS08
信号词 危险
危险声明

H302: 吞食有害

H315: 引起皮肤刺激

H318: 造成严重的眼睛损伤

H335: 可能引起呼吸道刺激

H361: 怀疑破坏生育力或未出生的孩子

H373: 通过长时间或反复暴露对器官造成损害

预防措施声明

P260: 不要吸入灰尘/烟雾/气体/雾/蒸汽/喷雾。

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。

P270: 使用本产品时,请勿进食、饮水或吸烟。

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...)。

P330: 漱口

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。

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。。。

P203: 使用前,获取、阅读并遵守所有安全说明。

P264+P265: 处理后彻底洗手[和…]。不要触摸眼睛。

P301+P317: 如果被吞咽:请寻求医疗帮助。

P305+P354+P338: 如果进入眼睛:立即用水冲洗几分钟。取下隐形眼镜(如果有的话),并且操作简单。继续冲洗。

P318: 如果暴露或担心,请就医。

P317: 寻求紧急医疗救助。

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。

WGK Germany 3
RTECS SZ6523500
Merck Index 229
个人防护装备 dust mask type N95 (US),Eyeshields,Gloves

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:

此产品的引用文献

引用文献

1. Xin-Yue Yang, Dan-Dan Wu, Cong-Cong Zhuang, Chao-Mei Ma.  (2023)  Anti-osteoporosis effects of mammalian lignans and their precursors from flaxseed and safflower seed using zebrafish model.  JOURNAL OF FOOD SCIENCE,  88  (12): (5278-5290).  [PMID:37889085] [10.1111/1750-3841.16816]
2. Lu Tan, Menghuan Li, Hang Chen, Yuchen Zhang, Yuan Liu, Maohua Chen, Zhong Luo, Kaiyong Cai, Yan Hu.  (2023)  Dynamic hydrogel with environment-adaptive autonomous wound-compressing ability enables rapid hemostasis and inflammation amelioration for hemorrhagic wound healing.  Nano Today,  52  (101962).  [10.1016/j.nantod.2023.101962]
3. Shi Jiawei, Bai Xuemeng, Zheng Yahui, Che Jianfei, Xiao Yinghong.  (2023)  Sugarcane Stem Derived Hybrid Scaffold for Bone Tissue Engineering via Top-down Approach.  COMPOSITE INTERFACES,  [10.1080/09276440.2022.2111773]
4. Wang Siqi, Jin Yao, Ai Wenhui, Wang Xiufeng, Zhang Zhiqing, Zhou Ting, Zhang Guodong, Wang Fang.  (2023)  H2O2 actuated molybdenum oxide nanodots: Multi-enzyme-like activities, leverage of Fenton reaction, and dual-mode sensitive detection of alendronate sodium.  Nano Research,  16  (10): (12106-12115).  [10.1007/s12274-023-5387-6]
5. Kai Zhang, Junlong Da, Jianqun Wang, Lixue Liu, Xinpeng Liu, Haoze Yuan, Lili Jiang, Yawei Geng, Xiaoyao Liu, Zhuling Jiang, Han Jin, Ying Li, Bin Zhang.  (2022)  Multifunctional Alendronate-PEI Carbon Dots for the Treatment of Bone-Destructive Diseases via Bidirectional Regulation of Osteoblast-Osteoclast Function.  Advanced Therapeutics,  (2): (2200149).  [10.1002/adtp.202200149]
6. Juan Tan, Ping Deng, Li Wang, Xiaoya Bi, Yiyao Zhou, Yi Wang, Pu Zhang.  (2022)  Signal-on and selective detection of anti-tumor adjunctive drug zoledronic acid using fluorescent sulfur quantum dots.  DYES AND PIGMENTS,  205  (110520).  [10.1016/j.dyepig.2022.110520]
7. Huang Xiuyu, Qiu Miaojuan, Wang Tianqi, Li Binbin, Zhang Shiqiang, Zhang Tianzhi, Liu Peng, Wang Qiang, Qian Zhi Rong, Zhu Chengming, Wu Meiying, Zhao Jing.  (2022)  Carrier-free multifunctional nanomedicine for intraperitoneal disseminated ovarian cancer therapy.  JOURNAL OF NANOBIOTECHNOLOGY,  20  (1): (1-15).  [PMID:35193583] [10.1186/s12951-022-01300-4]
8. Chunxiang Lin, Jinteng Chen, Zhihao Wu, Ruiyang Chi, Huiting Lin, Yifan Liu, Yuancai Lv, Xiaoxia Ye, Wei Luo.  (2022)  Phosphate-Functionalized Fibrous Adsorbent for Effectively Extracting Uranium from Seawater.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,  61  (5): (2227–2236).  [10.1021/acs.iecr.1c04355]
9. Yahui Zheng, Luyao Wang, Xuemeng Bai, Yinghong Xiao, Jianfei Che.  (2022)  Bio-inspired composite by hydroxyapatite mineralization on (bis)phosphonate-modified cellulose-alginate scaffold for bone tissue engineering.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,  635  (127958).  [10.1016/j.colsurfa.2021.127958]
10. Zhan Hao, Song Zhao, Qinghua Li, Yi Wang, Jun Zhang, Zhi Wang, Jixiao Wang.  (2021)  Reverse osmosis membranes with sulfonate and phosphate groups having excellent anti- scaling and anti-fouling properties.  DESALINATION,  509  (115076).  [10.1016/j.desal.2021.115076]
11. Qianqian Han, Lirong Huang, Ying Wang, Shixin Sun, Hao Huang, Fei Li, Fangtian Wang, Ligen Chen, Hongmei Zhang, Yanqing Wang.  (2021)  Platinum (II)-coordinated Portulaca oleracea polysaccharides as metal-drug based polymers for anticancer study.  COLLOIDS AND SURFACES B-BIOINTERFACES,  201  (111628).  [PMID:33639509] [10.1016/j.colsurfb.2021.111628]
12. Mengmeng Qin, Minghui Li, Ge Song, Canyu Yang, Peiyao Wu, Wenbing Dai, Hua Zhang, Xueqing Wang, Yiguang Wang, Demin Zhou, Bing He, Qiang Zhang.  (2021)  Boosting innate and adaptive antitumor immunity via a biocompatible and carrier-free nanovaccine engineered by the bisphosphonates-metal coordination.  Nano Today,  37  (101097).  [10.1016/j.nantod.2021.101097]
13. Yang Lei, Hu Yumin, Liu Yuanfen, Liu Yanyan, Miao Si, Li Zhen, Xu Bohui, Shen Yan.  (2020)  Preparation and in vitro evaluation of doxorubicin loaded alendronate modified hollow gold nanoparticles for bone-targeted chemo-photothermal therapy.  Materials Express,  10  (11): (1950-1959).  [10.1166/mex.2020.1862]
14. Nani Wang, Pingcui Xu, Xuping Wang, Weixuan Yao, Binjie Wang, Yuanzhao Wu, Dan Shou.  (2020)  Timosaponin AIII attenuates inflammatory injury in AGEs-induced osteoblast and alloxan-induced diabetic osteoporosis zebrafish by modulating the RAGE/MAPK signaling pathways.  PHYTOMEDICINE,  75  (153247).  [PMID:32502823] [10.1016/j.phymed.2020.153247]
15. Yingcong He, Ting Zhu, Lei Liu, Xuetao Shi, Zhengmei Lin.  (2018)  Modifying collagen with alendronate sodium for bone regeneration applications.  RSC Advances,  (30): (16762-16772).  [PMID:35540497] [10.1039/C8RA01872C]
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17. Shao-Qi Fu,Zi-Yuan Wang,Zheng-Meng Jiang,Zhi-Ming Bi,E-Hu Liu.  (2020-03-20)  Integration of Zebrafish Model and Network Pharmacology to Explore Possible Action Mechanisms of Morinda officinalis for Treating Osteoporosis..  Chemistry & biodiversity,  17  ((5)): (e2000056-e2000056).  [PMID:32190963]
18. Guoyu Yang, Jing Ye, Jingcheng Wang, Huijie Liu, Yanli Long, Junkai Jiang, Xinxin Miao, Jianjian Deng, Tianlong Wu, Tao Li, Xigao Cheng, Xiaolei Wang.  (2024)  “Three Birds, One Stone” Strategy of NIR-Responsive CO/H2S Dual-Gas Nanogenerator for Efficient Treatment of Osteoporosis.  Materials Today Bio,  (101179).  [PMID:39221209] [10.1016/j.mtbio.2024.101179]
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20. Yanbin Zhao, Yangyang Li, Bin Wang, Junyan Yao, Yue Fan, Peng He, Jing Bai, Cheng Wang, Feng Xue, Chenglin Chu.  (2024)  An Injectable Magnesium-Based Cement Stimulated with NIR for Drug-Controlled Release and Osteogenic Potential.  Advanced Healthcare Materials,  (2400207).  [PMID:38529833] [10.1002/adhm.202400207]
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