Name: Cangrelor Tetrasodium - 10mM in Water , Purinergic receptor P2Y12 antagonist, CAS No.163706-36-3, Purinergic receptor P2Y12 antagonist
SKU: C422011
Availability: InStock

Cangrelor Tetrasodium - 10mM in Water , Purinergic receptor P2Y12 antagonist, CAS No.163706-36-3, Purinergic receptor P2Y12 antagonist

CAS: 163706-36-3 Cat. No.: C422011 分子式: C₁₇H₂₁Cl₂F₃N₅Na₄O₁₂P₃S₂ 分子量: 864.29 EC番号: 813-784-1

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Cangrelor Tetrasodium - 10mM in Water CAS No(163706-36-3) by Aladdin Scientific

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注文可能

GRADE & PURITY 10mM in Water

Synonyms

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

概要 Specifications 名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造関連ターゲット（人間）作用メカニズム証明書（CoA、COO、BSE/TSEと分析図）化学的性質と物理的性質 Citations of This Product 参考文献ソリューション計算機レビュー

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Why this grade

10mM in Water for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

概要

Product Application：

Cangrelor has been used as a purinergic receptor P2Y12 antagonist to study its effects on neuromedin U receptor 2 (NMUR2)-coupled Gαi pathway during platelet aggregation.

Specifications

同義語

仕様と純度

10mM in Water

生化学的・生理学的メカニズム

Cangrelor is a potent and selective platelet P2Y12 antagonist. It is used as an intravenous antiplatelet drug to prevent formation of harmful blood clots in the coronary arteries. Cangrelor is an analog of nonthienopyridine adenosine triphosphate. It has

保管条件

Store at -80°C

入荷

Dry ice packs + Cold packs

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

アクションタイプ

ANTAGONIST

作用メカニズム

Purinergic receptor P2Y12 antagonist

名前と識別子

パブケム・シド	528771170
カノニカル・スマイル	CSCCNC1=C2C(=NC(=N1)SCCC(F)(F)F)N(C=N2)C3C(C(C(O3)COP(=O)([O-])OP(=O)(C(P(=O)([O-])[O-])(Cl)Cl)[O-])O)O.[Na+].[Na+].[Na+].[Na+]
IUPAC Name	tetrasodium;[dichloro(phosphonato)methyl]-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(2-methylsulfanylethylamino)-2-(3,3,3-trifluoropropylsulfanyl)purin-9-yl]oxolan-2-yl]methoxy-oxidophosphoryl]oxyphosphinate
InChIKey	COWWROCHWNGJHQ-OPKBHZIBSA-J
INCHI	1S/C17H25Cl2F3N5O12P3S2.4Na/c1-43-5-3-23-12-9-13(26-15(25-12)44-4-2-16(20,21)22)27(7-24-9)14-11(29)10(28)8(38-14)6-37-42(35,36)39-41(33,34)17(18,19)40(30,31)32;;;;/h7-8,10-11,14,28-29H,2-6H2,1H3,(H,33,34)(H,35,36)(H,23,25,26)(H2,30,31,32);;;;/q;4*+1/p-4/t8-,10-,11-,14-;;;;/m1..../s1
異性体SMILES	CSCCNC1=C2C(=NC(=N1)SCCC(F)(F)F)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])OP(=O)(C(P(=O)([O-])[O-])(Cl)Cl)[O-])O)O.[Na+].[Na+].[Na+].[Na+]
代替CAS番号	163706-06-7
分子量	864.29
Reaxy-Rn	38181652
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=38181652&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Nucleosides, nucleotides, and analogues
  - 分類 Purine nucleotides
    - Subclass Purine ribonucleotides

Kingdom	Organic compounds
Superclass	Nucleosides, nucleotides, and analogues
分類	Purine nucleotides
Subclass	Purine ribonucleotides
Intermediate Tree Nodes	Not available
Direct Parent	Purine ribonucleoside monophosphates
Alternative Parents	Pentose phosphates 6-alkylaminopurines Glycosylamines Monosaccharide phosphates Bisphosphonates Secondary alkylarylamines Alkylarylthioethers Aminopyrimidines and derivatives Alkyl phosphates Imidolactams N-substituted imidazoles Tetrahydrofurans Heteroaromatic compounds Organic phosphonic acids 1,2-diols Secondary alcohols Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Dialkylthioethers Organic metal halides Alkyl fluorides Organochlorides Alkyl chlorides Organofluorides Organophosphorus compounds Organic zwitterions Organic sodium salts Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-alkylaminopurine - 6-aminopurine - Monosaccharide phosphate - Bisphosphonate - Imidazopyrimidine - Purine - Aryl thioether - Aminopyrimidine - Secondary aliphatic/aromatic amine - Alkylarylthioether - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Imidolactam - Alkyl phosphate - Azole - Imidazole - Heteroaromatic compound - Organophosphonic acid - Organophosphonic acid derivative - Tetrahydrofuran - Secondary alcohol - 1,2-diol - Organic alkali metal salt - Sulfenyl compound - Azacycle - Oxacycle - Secondary amine - Organoheterocyclic compound - Thioether - Organic metal halide - Dialkylthioether - Alkyl chloride - Alkyl halide - Amine - Organohalogen compound - Organic nitrogen compound - Alcohol - Organic zwitterion - Hydrocarbon derivative - Organochloride - Organic oxide - Organofluoride - Organopnictogen compound - Organic salt - Organic oxygen compound - Organonitrogen compound - Organic sodium salt - Alkyl fluoride - Organooxygen compound - Organophosphorus compound - Organosulfur compound - Aromatic heteropolycyclic compound
説明	This compound belongs to the class of organic compounds known as purine ribonucleoside monophosphates. These are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached.
External Descriptors	Not available
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

3 D構造

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レビュー

📚 Citations by Application

Other applications1

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感度	light & Moisture sensitive
分子量	864.300 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	21
Rotatable Bond Count	14
Exact Mass	862.876 Da
Monoisotopic Mass	862.876 Da
Topological Polar Surface Area	318.000 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	1110.000
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	5