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· · COA & SDS すべての製品に適用 · 在庫品は当日出荷 ホーム 目標/経路/疾患別 リガンドファミリー 合成有機配位子 NE97220 - Moligand™ , Inhibitor of farnesyl diphosphate synthase, CAS No.70010-76-3, Inhibitor of farnesyl diphosphate synthase NE97220 - Moligand™ , Inhibitor of farnesyl diphosphate synthase, CAS No.70010-76-3, Inhibitor of farnesyl diphosphate synthase
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
CGA 103586;NE 97220;Q 332
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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
CGA 103586;NE 97220;Q 332
作用メカニズム
Inhibitor of farnesyl diphosphate synthase
名前と識別子 カノニカル・スマイル
Cc1cccnc1NC(P(=O)(O)O)P(=O)(O)O
IUPAC Name
{[(3-methylpyridin-2-yl)amino](phosphono)methyl}phosphonic acid
InChIKey
NAIJOBGUXRHQJW-UHFFFAOYSA-N
INCHI
1S/C7H12N2O6P2/c1-5-3-2-4-8-6(5)9-7(16(10,11)12)17(13,14)15/h2-4,7H,1H3,(H,8,9)(H2,10,11,12)(H2,13,14,15)
異性体SMILES
CC1=C(N=CC=C1)NC(P(=O)(O)O)P(=O)(O)O
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 Organic acids and derivatives 分類 Organic phosphonic acids and derivatives Subclass Bisphosphonates Intermediate Tree Nodes Not available Direct Parent Bisphosphonates Alternative Parents Secondary alkylarylamines Methylpyridines Imidolactams Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Bisphosphonate - Secondary aliphatic/aromatic amine - Methylpyridine - Pyridine - Imidolactam - Organophosphonic acid - Heteroaromatic compound - Secondary amine - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organophosphorus compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound 説明 This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms. 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.
3 D構造 関連ターゲット（人間） 関連ターゲット（非人間） 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 分子量 282.130 g/mol XLogP3 -1.900 Hydrogen Bond Donor Count 5 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 4 Exact Mass 282.017 Da Monoisotopic Mass 282.017 Da Topological Polar Surface Area 140.000 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 330.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 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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