フルニキシンメグルミン
Flunixin Meglumine
基本情報
- CAS
42461-84-7- 標準SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F- InChIKey
MGCCHNLNRBULBU-WZTVWXICSA-N- 分子式
- C21H28F3N3O7
- 平均分子量
- 491.5 g/mol
概要
Flunixin meglumine is an organoammonium salt obtained by combining flunixin with one molar equivalent of 1-deoxy-1-(methylamino)-D-glucitol. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic properties; used in veterinary medicine for treatment of horses, cattle and pigs. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic and an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor. It contains a flunixin(1-).
名称と識別子
- 優先名称
- Flunixin Meglumine
- IUPAC
- (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid
- 現地名
- フルニキシンメグルミン
- 英語名
- Flunixin Meglumin
- 分子式
- C14H11F3N2O2.C7H17NO5
- 分子量
- 491.46
名称と別名
FLUNIXIN MEGLUMINE42461-84-7BanamineFlumeglumineSch 14714 meglumineFlunixin-SFlunixin N-methylglucanineSch-14714 meglumine8Y3JK0JW3UFlunixin meglumine saltFlunazineNSC-759583
名称をさらに表示
フルニキシンメグルミンフィナジンバナミン1-デオキシ-1-(メチルアミノ)-D-グルシトール·2-[[2-メチル-3-(トリフルオロメチル)フェニル]アミノ]-3-ピリジンカルボン酸フルニキシンメグルミン標準品1-デオキシ-1-(メチルアミノ)-D-グルシトール・2-[[2-メチル-3-(トリフルオロメチル)フェニル]アミノ]-3-ピリジンカルボン酸flunixin megluminFlunixin Meglunine1-deoxy-1-(methylamino)-d-glucito2-((2-methyl-3-(trifluoromethyl)phenyl)amFinadyneEquileveNIH 10250fluixi egluieIliuM Flunixil
CHEBI:761442-((2-Methyl-3-(trifluoromethyl)-phenyl)amino)-3-pyridinecarboxylic acid with meglumine compoundedDTXCID9025584FlunineVetaMegBanamine PasteFlunazine-SVetameg S
物性
構造計算による物性
- 極性表面積
- 175 Ų
- 水素結合供与体数
- 8
- 水素結合受容体数
- 13
- 回転可能結合数
- 9
- 重原子数
- 34
- 形式電荷
- 0
- 複雑度
- 510
実験および物理化学的性質
DrugsDEA NFLIS-Drug Category -> Analgesics
Animal DrugsActive Ingredients (Flunixin Meglumine) -> FDA Greenbook
物理化学的性質
- 融点
- 136.6 · 136.6-137.4 °C
- 比旋光度
- -9 · -9~-12゜(D/20℃)(c=12,CH3OH)
- 貯蔵温度
- room temp
- 溶解性
- 2 O: · H2O: 溶けやすい
- 外見
- 個体
- 色
- オフホワイト
- 水溶解度
- 溶ける
- InChIKey
- MGCCHNLNRBULBU-WZTVWXICSA-N
- SMILES
- CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.Cc1c(Nc2ncccc2C(O)=O)cccc1C(F)(F)F
化学的性質
化学的特性White Solid
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 0.5% (1 of 215) of reports.
Danger
H301 (79.5%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 215 reports by companies from 21 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationFlunixin meglumine: 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.
Other Safety InformationIMAP assessments - D-Glucitol, 1-deoxy-1-(methylamino)-, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-3-pyridinecarboxylate (salt): Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 3 (79.5%)
安全データ
- wgk
- 3
- rtecs
- LZ4367000
- ridadr
- UN 2811 6.1 / PGI
- hs_code
- 29339900
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- ストレージクラス
化学と産業
薬理情報
MeSH Pharmacological Classification
Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects.
Drugs that are used to reduce body temperature in fever.
用途と製造
Use ClassificationAnimal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients
応用分野
使用Flunixin meglumine has been used as a nonsteroidal anti-inflammatory drug standard in electrospray ionization mass spectrometry (LC-ESI/MS).
一般的な説明Flunixin meglumine is a nonsteroidal anti-inflammatory drug and a potent cyclo-oxygenase (COX) inhibitor. It is commonly used as an analgesic and antipyretic in animals.Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
補足説明
定義ChEBI: An organoammonium salt obtained by combining flunixin with one molar equivalent of 1-deoxy-1-(methylamino)-D-glucitol. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic propert es; used in veterinary medicine for treatment of horses, cattle and pigs.
関連反応
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化合物ノート
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