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· · COA & SDS available for every product · Same-day shipping on in-stock items A134974 - Moligand™ , Inhibitor of Adenosine kinase, CAS No.186141-75-3, Inhibitor of Adenosine kinase
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
A134974 | a-134974 | (1S,2R,3S,5R)-3-Amino-5-(4-amino-5-iodopyrrolo[2,3-d]pyrimidin-7-yl)cyclopentane-1,2-diol | GTPL5130 | AKOS040750017 | DTXSID001018121 | SMP2_000021 | (1S,2R,3S,5R)-3-amino-5-{4-amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl}cyclopentan
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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 Synonyms
A134974 | a-134974 | (1S, 2R, 3S, 5R)-3-Amino-5-(4-amino-5-iodopyrrolo[2, 3-d]pyrimidin-7-yl)cyclopentane-1, 2-diol | GTPL5130 | AKOS040750017 | DTXSID001018121 | SMP2_000021 | (1S, 2R, 3S, 5R)-3-amino-5-{4-amino-5-iodo-7H-pyrrolo[2, 3-d]pyrimidin-7-yl}cyclopentan
Specifications & Purity
Moligand™
Mechanism of action
Inhibitor of Adenosine kinase
Names and Identifiers Canonical Smiles N[C@H]1C[C@H]([C@@H]([C@@H]1O)O)n1cc(c2c1ncnc2N)I IUPAC Name (1S,2R,3S,5R)-3-amino-5-{4-amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl}cyclopentane-1,2-diol InChIKey NSXJHIFQIZKLGF-LWIVVEGESA-N INCHI 1S/C11H14IN5O2/c12-4-2-17(6-1-5(13)8(18)9(6)19)11-7(4)10(14)15-3-16-11/h2-3,5-6,8-9,18-19H,1,13H2,(H2,14,15,16)/t5-,6+,8+,9-/m0/s1 Isomeric SMILES C1[C@@H]([C@H]([C@H]([C@@H]1N2C=C(C3=C(N=CN=C32)N)I)O)O)N PubChem CID 9885936
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.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Pyrrolopyrimidines Subclass Pyrrolo[2,3-d]pyrimidines Intermediate Tree Nodes Not available Direct Parent Pyrrolo[2,3-d]pyrimidines Alternative Parents Aminopyrimidines and derivatives Substituted pyrroles Imidolactams Cyclopentanols Aryl iodides Heteroaromatic compounds Cyclic alcohols and derivatives 1,2-diols 1,2-aminoalcohols Azacyclic compounds Organopnictogen compounds Organoiodides Monoalkylamines Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Pyrrolo[2,3-d]pyrimidine - Aminopyrimidine - Aryl halide - Aryl iodide - Imidolactam - Substituted pyrrole - Pyrimidine - Cyclopentanol - Heteroaromatic compound - Pyrrole - Cyclic alcohol - 1,2-aminoalcohol - 1,2-diol - Secondary alcohol - Azacycle - Organoiodide - Organohalogen compound - Primary aliphatic amine - Organooxygen compound - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Amine - Alcohol - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions. External Descriptors Not available 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.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 375.170 g/mol XLogP3 -1.100 Hydrogen Bond Donor Count 4 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 1 Exact Mass 375.019 Da Monoisotopic Mass 375.019 Da Topological Polar Surface Area 123.000 Ų Heavy Atom Count 19 Formal Charge 0 Complexity 349.000 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 1
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