Adenosine 5ʹ-Triphosphate, Disodium Salt (ATP) - ≥98% , CAS No.987-65-5

CAS: 987-65-5 Cat. No.: A100880 Molecular Weight: 551.15 EC Number: 213-579-1

GRADE & PURITY ≥98%

Synonyms

EINECS 213-579-1 | Adenosine 5'-Triphosphate, disodium salt | Disodium adenosine triphosphate | DTXSID80891312 | Triphosadenine | ((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate, disodium salt |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Adenosine 5'-Triphosphate, disodium salt is a p2 purinergic (P2X and P2Y) agonist that increases Ca2+-activated K+ channel activity. It has been found to induce a release of prostoglandin D2 and histamine from rat peritoneal mast cells in a dose-dependent manner.

Specifications

Synonyms

EINECS 213-579-1 | Adenosine 5'-Triphosphate, disodium salt | Disodium adenosine triphosphate | DTXSID80891312 | Triphosadenine | ((2R, 3S, 4R, 5R)-5-(6-Amino-9H-purin-9-yl)-3, 4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate, disodium salt |

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

P2 purinoceptor agonist.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488181904
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181904
• Canonical Smiles: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)([O-])OP(=O)(O)[O-])O)O)N.[Na+].[Na+]
• IUPAC Name: disodium;[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-oxidophosphoryl] hydrogen phosphate
• InChIKey: TTWYZDPBDWHJOR-IDIVVRGQSA-L
• INCHI: 1S/C10H16N5O13P3.2Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20;;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7-,10-;;/m1../s1
• Isomeric SMILES: C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)([O-])OP(=O)(O)[O-])O)O)N.[Na+].[Na+]
• Molecular Weight: 551.15
• Reaxy-Rn: 59222974
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=59222974&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Class Purine nucleotides
      • Subclass Purine ribonucleotides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Class: Purine nucleotides
• Subclass: Purine ribonucleotides
• Intermediate Tree Nodes: Not available
• Direct Parent: Purine ribonucleoside triphosphates
• Alternative Parents: Purine ribonucleoside monophosphates Pentose phosphates Glycosylamines 6-aminopurines Monosaccharide phosphates Aminopyrimidines and derivatives Monoalkyl phosphates Imidolactams N-substituted imidazoles Tetrahydrofurans Heteroaromatic compounds 1,2-diols Secondary alcohols Oxacyclic compounds Azacyclic compounds Organic zwitterions Organopnictogen compounds Hydrocarbon derivatives Primary amines Organic sodium salts Organic oxides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Purine ribonucleoside triphosphate - Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Imidolactam - N-substituted imidazole - Alkyl phosphate - Monosaccharide - Pyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Tetrahydrofuran - Imidazole - Heteroaromatic compound - Azole - Secondary alcohol - 1,2-diol - Azacycle - Organic alkali metal salt - Oxacycle - Organoheterocyclic compound - Organic sodium salt - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Alcohol - Organic oxygen compound - Organic nitrogen compound - Primary amine - Hydrocarbon derivative - Amine - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as purine ribonucleoside triphosphates. These are purine ribobucleotides with a triphosphate group linked to the ribose moiety.
• External Descriptors: organic sodium salt

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Solvent:water, Max Conc. mg/mL: 55.11, Max Conc. mM: 100
• Melt Point(°C): 188-190°C
• Molecular Weight: 551.140 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 8
• Exact Mass: 550.96 Da
• Monoisotopic Mass: 550.96 Da
• Topological Polar Surface Area: 285.000 Ų
• Heavy Atom Count: 33
• Formal Charge: 0
• Complexity: 789.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3

References

1. Ting Liu, Ling Wang, Yang Yu, Zhuo Zhang, Zelong Duan, Yawen Li, Chencan Li.  (2023)  Adenosine Triphosphatase-Stabilized ZIF-67 as Peroxidase Mimic for Rapid Detection of Glutathione.  INORGANIC CHEMISTRY COMMUNICATIONS,      [PMID:] [10.1016/j.inoche.2023.111705]

2. Ting Zeng, Jie Yin, Ziwen Liu, Zhaoxing Li, Yu Zhang, Yang Lv, Mei-Ling Lu, Min Luo, Meirong Chen, Yibei Xiao.  (2023)  Mechanistic insights into transposon cleavage and integration by TnsB of ShCAST system.  Cell Reports,      [PMID:37379212] [10.1016/j.celrep.2023.112698]

3. Hong Liu, Xuliang Yang, Bo Huang, Hongxiang Liu.  (2023)  A universal approach for synthesis of copper nanoclusters templated by G-rich oligonucleotide sequences and their applications in sensing.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:37080047] [10.1016/j.saa.2023.122740]

4. Minglei Tao, Shengzhi Liu, Yaohan Li, Amin Liu, Zijian Sun, Vinesh Maharaj, Shouxin Li, Jingkui Tian, Wei Zhu.  (2023)  Comprehensive multi-omics analysis reveals the importance of CtCOSY in the energy metabolism and coumarin biosynthesis in Clematis terniflora DC.  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2023.116444]

5. Yue Xin, Dun Zhang, Yan Zeng, Yingwen Wang, Peng Qi.  (2023)  A dual-emission ratiometric fluorescent sensor based on copper nanoclusters encapsulated in zeolitic imidazolate framework-90 for rapid detection and imaging of adenosine triphosphate.  Analytical Methods,  15  (6): (788-796).  [PMID:36691974] [10.1039/D2AY01932A]

6. Yue Xin, Dun Zhang, Yan Zeng, Peng Qi.  (2022)  An abiotic carbon dots@ ZIF-90 fluorescent probe for rapid and reliable detection of adenosine triphosphate.  ANALYTICAL BIOCHEMISTRY,      [PMID:36539047] [10.1016/j.ab.2022.115021]

7. Jinling Xu, Qi Lv, Shumin Pan, Huanhuan Qiu, Yu Liao, Ming Zhou, Weijie Li, Caiyan Li, Pan Zhang, Yujian Li, Guanglin Xu, Qingfeng Yu.  (2022)  M378 exhibits anti-inflammatory activities through NLRP3 signaling pathway.  EUROPEAN JOURNAL OF PHARMACOLOGY,      [PMID:36100126] [10.1016/j.ejphar.2022.175261]

8. Jiulong Zhang, Xiaoyan Sun, Lin Liu, Xiufeng Zhao, Chunrong Yang, Kexin Li, Haiyang Hu, Mingxi Qiao, Dawei Chen, Xiuli Zhao.  (2022)  Tumor-permeated ATP-based size-controllable immunogenic cell death amplifier remodel immunosuppressive microenvironment to boost cancer immunotherapy.  Applied Materials Today,      [PMID:] [10.1016/j.apmt.2022.101518]

9. Jiulong Zhang, Xiaoyan Sun, Xiufeng Zhao, Chunrong Yang, Menghao Shi, Benzhuo Zhang, Haiyang Hu, Mingxi Qiao, Dawei Chen, Xiuli Zhao.  (2022)  Combining immune checkpoint blockade with ATP-based immunogenic cell death amplifier for cancer chemo-immunotherapy.  Acta Pharmaceutica Sinica B,      [PMID:36176905] [10.1016/j.apsb.2022.05.008]

10. Jiulong Zhang, Xiaoyan Sun, Xiufeng Zhao, Lin Liu, Xin Cheng, Chunrong Yang, Haiyang Hu, Mingxi Qiao, Dawei Chen, Xiuli Zhao.  (2022)  Watson–Crick Base Pairing-Inspired Laser/GSH Activatable miRNA-Coordination Polymer Nanoplexes for Combined Cancer Chemo-Immuno-Photothermal Therapy.  ACS Applied Materials & Interfaces,      [PMID:35476413] [10.1021/acsami.2c03523]

11. Yunjing Shi, Jinjie Wang, Kun Mu, Suqin Liu, Guang Yang, Min Zhang, Jingxia Yang.  (2021)  Copper (II) Ion-Modified Gold Nanoclusters as Peroxidase Mimetics for the Colorimetric Detection of Pyrophosphate.  SENSORS,  21  (16): (5538).  [PMID:34450980] [10.3390/s21165538]

12. Xun Wang, Jie Liu, Yimin Zhu, Yanjun Li.  (2021)  Selective adsorption of Na2ATP as an eco-friendly depressant on the calcite surface for effective flotation separation of cassiterite from calcite.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2021.126899]

13. Xun Wang, Jie Liu, Yimin Zhu, Yanjun Li.  (2021)  The application and mechanism of high-efficiency depressant Na2ATP on the selective separation of cassiterite from fluorite by direct flotation.  MINERALS ENGINEERING,      [PMID:] [10.1016/j.mineng.2021.106963]

14. Yutong Wang, Lijun Yang, Mengfan Wang, Jiaxing Zhang, Wei Qi, Rongxin Su, Zhimin He.  (2021)  Bioinspired Phosphatase-like Mimic Built from the Self-Assembly of De Novo Designed Helical Short Peptides.  ACS Catalysis,      [PMID:] [10.1021/acscatal.1c00129]

15. Hang Wang, Nanan Sun, Xianlin Xu, Shubo Wang, Weimin Kang, Xupin Zhuang, Yan Yin, Bowen Cheng.  (2020)  Adenosine triphosphate@graphene oxide proton channels for proton exchange membranes constructed via electrostatic layer-by-layer deposition.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2020.118880]

16. Wenpo Feng, Chenxi Feng, Binbin Wang, Aihua Jing, Guangda Li, Xichao Xia, Gaofeng Liang.  (2020)  An amorphous calcium phosphate for drug delivery: ATP provides a phosphorus source and microwave-assisted hydrothermal synthesis.  Materials Today Communications,      [PMID:] [10.1016/j.mtcomm.2020.101455]

17. Xiaoyu Wang, Xiaoqian Jiang, Hui Wei.  (2020)  Phosphate-responsive 2D-metal–organic-framework-nanozymes for colorimetric detection of alkaline phosphatase.  Journal of Materials Chemistry B,  8  (31): (6905-6911).  [PMID:32424386] [10.1039/C9TB02542A]

18. Wenxiu Luo, Xue Zhao, Wei Cheng, Yun Zhang, Yi Wang, Guangyin Fan.  (2020)  A simple and straightforward strategy for synthesis of N,P co-doped porous carbon: an efficient support for Rh nanoparticles for dehydrogenation of ammonia borane and catalytic application.  Nanoscale Advances,  2  (4): (1685-1693).  [PMID:36132330] [10.1039/D0NA00007H]

19. Shun Hu, Xiaona Li, Kai Wang, Qiuhua Wu, Guolin Zhang, Xue Liu.  (2020)  Sensor array based on carbon dots for ATP-related physiological phosphates detecting and ATP hydrolysis monitoring.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2020.127851]

20. Wang Jiaqi, Wang Chen, Fan Li, Zhao Liang, Tan Wen-Song.  (2019)  Simultaneous detection of nicotinamide adenine nucleotides and adenylate pool to quantify redox and energy states in mAb-producing CHO cells by capillary electrophoresis.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  411  (13): (2971-2979).  [PMID:30923861] [10.1007/s00216-019-01747-9]

21. Lihua Liu, Qiang Zhang, Jing Wang, Linlin Zhao, Lixia Liu, Yan Lu.  (2019)  A specific fluorescent probe for fast detection and cellular imaging of cysteine based on a water-soluble conjugated polymer combined with copper(II).  TALANTA,      [PMID:30876540] [10.1016/j.talanta.2019.02.003]

22. Li Qin, Xiaoyu Wang, Yufeng Liu, Hui Wei.  (2018)  2D-Metal–Organic-Framework-Nanozyme Sensor Arrays for Probing Phosphates and Their Enzymatic Hydrolysis.  ANALYTICAL CHEMISTRY,      [PMID:30044077] [10.1021/acs.analchem.8b02428]

23. Qu Fei, Mao Beibei, Xue Fangfang, Xia Lian, You Jinmao, Song Cuihua.  (2018)  Photoinduced electron transfer from polymer-templated Ag nanoclusters to G-quadruplex-hemin complexes for the construction of versatile biosensors and logic gate applications.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  410  (8): (2211-2219).  [PMID:29387952] [10.1007/s00216-018-0887-z]

24. Li Yuan, Qingling Dang, Jianlou Mu, Xueping Feng, Ruichang Gao.  (2018)  Mobility and redistribution of waters within bighead carp (Aristichthys nobilis) heat-induced myosin gels.  INTERNATIONAL JOURNAL OF FOOD PROPERTIES,      [PMID:] [10.1080/10942912.2018.1476872]

25. Hengchang Ma, Manyi Yang, Caili Zhang, Yucheng Ma, Yanfang Qin, Ziqiang Lei, Lu Chang, Lei Lei, Tao Wang, Yuan Yang.  (2017)  Aggregation-induced emission (AIE)-active fluorescent probes with multiple binding sites toward ATP sensing and live cell imaging.  Journal of Materials Chemistry B,  5  (43): (8525-8531).  [PMID:32264520] [10.1039/C7TB02399E]

26. Shan Sun, Kai Jiang, Sihua Qian, Yuhui Wang, Hengwei Lin.  (2017)  Applying Carbon Dots-Metal Ions Ensembles as a Multichannel Fluorescent Sensor Array: Detection and Discrimination of Phosphate Anions.  ANALYTICAL CHEMISTRY,      [PMID:28452216] [10.1021/acs.analchem.7b00602]

27. Yihui Hu, Wenjing Guo, Yubin Ding, Hanjun Cheng, Hui Wei.  (2016)  Modulating luminescence of Tb3+ with biomolecules for sensing heparin and its contaminant OSCS.  BIOSENSORS & BIOELECTRONICS,      [PMID:27494809] [10.1016/j.bios.2016.07.085]

28. Pan Zhu, Song Wang, Jian Wang, Li Zhou, Ping Shi.  (2015)  A capillary zone electrophoresis method for adenine nucleotides analysis in Saccharomyces cerevisiae.  JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES,      [PMID:26655107] [10.1016/j.jchromb.2015.11.040]

29. Dan Liu, Tianbin Zhang, Yechun Cheng, Qiong Jia.  (2014)  Poly(glycidyl methacrylate-co-N-methylolacrylamide-co-ethylene dimethacrylate) monolith coupled to high-performance liquid chromatography for the determination of adenosine phosphates in royal jelly.  JOURNAL OF SEPARATION SCIENCE,  37  (14): (1826-1833).  [PMID:24753458] [10.1002/jssc.201400187]

30. Yukang Wang, Gaochen Jin, Shuyan Song, Yijun Jin, Xiaowen Wang, Shuaiqi Yang, Xingxing Shen, Yinbo Gan, Yuexing Wang, Ran Li, Jian-Xiang Liu, Jianping Hu, Ronghui Pan.  (2024)  A peroxisomal cinnamate:CoA ligase-dependent phytohormone metabolic cascade in submerged rice germination.  DEVELOPMENTAL CELL,      [PMID:38579719] [10.1016/j.devcel.2024.03.023]

31. Liwei Zhu, Ting Liu, Zelong Duan, Ling Wang, Xuefan Qiu, Zhihan Sun, Chencan Li.  (2024)  Adenosine triphosphatase synergetic cobalt metal-organic frameworks with enhanced peroxidase-like activity for L-cystine detection.  INORGANICA CHIMICA ACTA,      [PMID:] [10.1016/j.ica.2024.122375]

32. Guobin Huang, Qian Xie, Jinxin Chi, Chenchen Lin, Xucong Lin, Zenghong Xie.  (2024)  Magneto-fluorescent nanobiosensor with tetrahedral framework nucleic acid-confined aptamer for trace adenosine triphosphate detection.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2024.136129]

33. Qinqin Sun, Fei Yan, Bin Su.  (2018)  Label-free electrochemical biosensors based on 3,3′,5,5′-tetramethylbenzidine responsive isoporous silica-micelle membrane.  BIOSENSORS & BIOELECTRONICS,      [PMID:29412936] [10.1016/j.bios.2018.01.026]

34. Chao Gao, Ye Feng, Suyi Liu, Bin Chen, Miaomiao Ding, Dailing Du, Wenjing Zhang, Daniela A. Wilson, Yingfeng Tu, Fei Peng.  (2025)  Light-Driven Artificial Cell Micromotors for Degenerative Knee Osteoarthritis.  ADVANCED MATERIALS,      [PMID:40025988] [10.1002/adma.202416349]

35. Yunjie Ren, Yueyuan Li, Min Qing, Yonghua Yuan, Jing Zhou, Lijuan Bai.  (2025)  MOF-Wrapped Cu Nanocluster-Based Fluorescent Sensor Array for Phosphates High-Throughput Analysis and Their Enzymatic Hydrolysis Monitoring.  ACS Applied Nano Materials,      [PMID:] [10.1021/acsanm.5c02996]

36. Haoran Zheng, Jiayu Guo, Han Wang, Yurou Wang, Wenxiang Zhou, Ke Liu, Qiang Ma, Yanfei Qi.  (2025)  A zeolitic imidazolate framework-90 enhanced ultrasensitive ATP sensing platform with HCR and CRISPR-Cas12a dual signal amplification for live bacteria detection.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:40378737] [10.1016/j.jhazmat.2025.138612]

37. Wenhui Qu, Luying Tang, Ruoshu Li, Weijia Liu, Xiaoming Jiang, Qing Kong, Yunqi Wen, Changhu Xue.  (2025)  Using machine learning method to predict the quality of fermented krill sauce based on the freshness of Antarctic krill.  FOOD CHEMISTRY,      [PMID:41499898] [10.1016/j.foodchem.2025.147833]

38. Yingying Xie, Haoming He, Yike Li, Qiang Chen, Sunjing Fu, Zhe Wang, Gaiyan Feng, Yanping Li, YanXiang Gao, Jingang Zheng.  (2026)  Eicosapentaenoic Acid Attenuates Heart Failure with Preserved Ejection Fraction Via Promoting TREM2-Dependent Efferocytosis.  PHYTOMEDICINE,      [PMID:41655546] [10.1016/j.phymed.2026.157886]