基本情報
- CAS
24292-60-2- 標準SMILES
NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)([O-])[O-])[C@@H]3O)[C@@H](O)[C@H]2O)c1.[Na+].[Na+]- InChIKey
WSDDJLMGYRLUKR-WUEGHLCSSA-L- 分子式
- C21H26N7Na2O17P3
- 平均分子量
- 787.4 g/mol
- 単同位体質量
- 787.03934194
名称と識別子
- 優先名称
- Nadide phosphate disodium
- IUPAC
- disodium;[(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-5-[[[[(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate
- 現地名
- トリホスホピリジンヌクレオチド二ナトリウム塩
- 英語名
- NADP, Disodium Salt
- 分子式
- C21H29N7NaO17P3
- 分子量
- 767.41
名称と別名
24292-60-2Nadide phosphate disodiumDisodium NADPNAD SODIUM PHOSPHATE1ZCR3Z51KVDTXSID401044998RefChem:831678DTXCID101526943ADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), 2'-(DIHYDROGEN PHOSPHATE), P'->5'-ESTER WITH 3-(AMINOCARBONYL)-1-.BETA.-D-RIBOFURANOSYLPYRIDINIUM, INNER SALT, DISODIUM SALTADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), 2'-(DIHYDROGEN PHOSPHATE), P'->5'-ESTER WITH 3-(AMINOCARBONYL)-1-BETA-D-RIBOFURANOSYLPYRIDINIUM, INNER SALT, DISODIUM SALTNADP DisodiumNADP disodium salt
名称をさらに表示
トリホスホピリジンヌクレオチド二ナトリウム塩Β-ニコチンアミドアデニンジヌクレオチドりん酸二ナトリウム塩Β-ニコチンアミドアデニンジヌクレオチドリン酸 二ナトリウム塩NADP-2NaNADHPβ-NADPΒ-NICOTINAMIDE ADENINE DINUCLEOTIDE PHOSPHATENADP, NA2β-Nicotinamide adenine dinucleotide phosphate disodium saltNADP-4Naβ-NADP-2Na
beta-Nicotinamide adenine dinucleotide phosphate disodium saltTriphosphopyridine nucleotide disodium saltb-NADH phosphate disodium saltMFCD00065390disodium;[(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-5-[[[[(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphateb-Nicotinamide adenine dinucleotide phosphate disodium saltNADP, Disodium saltbeta-Nicotinamide adenine dinucleotide phosphate monosodium salt
物性
構造計算による物性
- 極性表面積
- 373 Ų
- 水素結合供与体数
- 6
- 水素結合受容体数
- 21
- 回転可能結合数
- 12
- 重原子数
- 50
- 形式電荷
- 0
- 複雑度
- 1,280
物理化学的性質
- 融点
- 175 · 175-178 °C
- 比重(密度)
- 1.66 g/cm3 · 1.66g/cm3 at 20℃
- 蒸気圧
- 0.002 · 0.002-0.004Pa at 20-25℃
- 貯蔵温度
- -20 °C · -20°C
- 溶解性
- DMSO (Slightly), Water (Slightly)
- 外見
- 粉
- 色
- 黄色
- PH
- 4 · 4.0 ± 1.0(10mg/mL)
- 臭い (Odor)
- 無臭
- 水溶解度
- 50 g/L · >50g/L
- 安定性
- Hygroscopic
- InChIKey
- UNRRSQIQTVFDLS-WUEGHLCSSA-L
- SMILES
- [Na+].[Na+].NC(=O)c1ccc[n+](c1)C2O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](OP(O)([O-])=O)[C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O
- LogP
- -4.4 at · -4.4 at 20℃ and pH7
- 表面張力
- 73.2 mN/m · 73.2mN/m at 1g/L and 20℃
- CAS データベース
- 24292 · 24292-60-2
化学的性質
化学的特性Yellowish powder
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (7 of 7) of all reports.
Not Classified
Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
REACH registered substance: Adenosine 5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), 5'→5'-ester with 3-(aminocarbonyl)-1-β-d-ribofuranosylpyridinium hydroxide, inner salt, disodium salt (EC: 246-129-8)
Adenosine 5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'â5'-ester with 3-(aminocarbonyl)-1-.beta.-D-ribofuranosylpyridinium, inner salt, disodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
安全データ
- F
- 10-21
- wgk
- 3
- hs_code
- 29349990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 22-24/25-37/39-36-26
- ストレージクラス
- 11 - Combustible Solids
化学と産業
応用分野
説明NADP+ is a coenzyme that is widely distributed in living matter, Participates in oxidation-reduction reactions. It serves as an electron carrier in a number of reactions, being alternately oxidized (NADP+) and reduced (NADPH).NADP is a substance in which nicotinic acid amide adenine dinucleotide and a phosphate molecule are bound by ester bond. It is a hydrogen receptor and can be used for the development and development of a variety of in vitro diagnostic reagents. Prepared in large quantities.
使用Disodium NADP (NADP-NA2) is used in method for preparing 2,4-Diamino Butyric Acid by enzyme catalysis.
一般的な説明Nicotinamide adenine dinucleotide phosphate (NADP) and NADPH form a redox pair. The NADPH/NADP ratio regulates the intracellular redox potential, thereby influencing metabolic reactions in vivo.
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