Ap3a - Moligand™ , Agonist of P2Y 1 receptor, CAS No.A607670, Agonist of P2Y 1 receptor

CAS: A607670 Cat. No.: A607670 PubChem CID: 165381
注文可能
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
Synonyms
Adenosine(3)triphosphate adenosine | ApppA | P1,P3-Bis(5'-adenosyl) triphosphate | P(1),P(3)-bis(5''-adenosyl) trihydrogen triphosphate | P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate | 5'Ap3A | diadenosine triphosphate | N-(3-amino-propyl)diethanol
Storage
Room temperature
Size
USA
ドイツ (EU)*
Price
Qty
5mg
A607670-5mg
受注生産 · 8~12週間

$1,142.90

$1,334.90
保存 $192.00 (14.38%)
25mg
A607670-25mg
受注生産 · 8~12週間

$1,714.90

$2,000.90
保存 $286.00 (14.29%)
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

同義語
Adenosine(3)triphosphate adenosine | ApppA | P1,P3-Bis(5'-adenosyl) triphosphate | P(1),P(3)-bis(5''-adenosyl) trihydrogen triphosphate | P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate | 5'Ap3A | diadenosine triphosphate | N-(3-amino-propyl)diethanol
仕様と純度
Moligand™
保管条件
Room temperature
等級
Moligand™
アクションタイプ
AGONIST
作用メカニズム
Agonist of P2Y 1 receptor
名前と識別子
カノニカル・スマイルO[C@@H]1[C@@H](COP(=O)(OP(=O)(OP(=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)O)O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
IUPAC Name{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphinic acid
InChIKeyQCICUPZZLIQAPA-XPWFQUROSA-N
INCHI1S/C20H27N10O16P3/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(43-19)1-41-47(35,36)45-49(39,40)46-48(37,38)42-2-8-12(32)14(34)20(44-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
異性体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)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)N
PubChem CID 165381

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ 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.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassNucleosides, nucleotides, and analogues
分類(5'->5')-dinucleotides
SubclassNot available
Intermediate Tree Nodes Not available
Direct Parent(5'->5')-dinucleotides
Alternative Parents Purine ribonucleoside triphosphates  Purine nucleotide sugars  Purine ribonucleoside monophosphates  Pentose phosphates  Glycosylamines  6-aminopurines  Monosaccharide phosphates  Aminopyrimidines and derivatives  Monoalkyl phosphates  N-substituted imidazoles  Imidolactams  Tetrahydrofurans  Heteroaromatic compounds  Secondary alcohols  Oxacyclic compounds  Azacyclic compounds  Hydrocarbon derivatives  Organic oxides  Organopnictogen compounds  Primary amines  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents (5'->5')-dinucleotide - Purine ribonucleoside triphosphate - Purine nucleotide sugar - Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Alkyl phosphate - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Tetrahydrofuran - Secondary alcohol - Azacycle - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organic nitrogen compound - Primary amine - Organonitrogen compound - Alcohol - Organooxygen compound - Aromatic heteropolycyclic compound
説明This compound belongs to the class of organic compounds known as (5'->5')-dinucleotides. These are dinucleotides where the two bases are connected via a (5'->5')-phosphodiester linkage.
External Descriptors diadenosyl triphosphate
3 D構造
インタラクティブ化学構造モデル





関連ターゲット(人間)
P2RY1 Tchem P2Y purinoceptor 1 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
P2RY1 Tchem Purinergic receptor P2Y1 (1327 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
P2RY2 Tclin Purinergic receptor P2Y2 (1109 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
FHIT Tchem Bis(5'-adenosyl)-triphosphatase (95 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NUDT3 Tbio Diphosphoinositol polyphosphate phosphohydrolase 1 (15 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NUDT10 Tbio Diphosphoinositol polyphosphate phosphohydrolase 3-alpha (12 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NUDT4 Tbio Diphosphoinositol polyphosphate phosphohydrolase 2 (12 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
関連ターゲット(非人間)
Eif4e Eukaryotic translation initiation factor 4E (654 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
化学的性質と物理的性質
分子量756.400 g/mol
XLogP3-7.200
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count24
Rotatable Bond Count12
Exact Mass756.082 Da
Monoisotopic Mass756.082 Da
Topological Polar Surface Area387.000 Ų
Heavy Atom Count49
Formal Charge0
Complexity1240.000
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
ソリューション計算機
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