ミバクリウムクロリド
Mivacurium Chloride
基本情報
- CAS
106861-44-3- 標準SMILES
COc1cc2c(cc1OC)[C@@H](Cc1cc(OC)c(OC)c(OC)c1)[N+](C)(CCCOC(=O)CC/C=C/CCC(=O)OCCC[N+]1(C)CCc3cc(OC)c(OC)cc3[C@H]1Cc1cc(OC)c(OC)c(OC)c1)CC2.[Cl-].[Cl-]- InChIKey
WMSYWJSZGVOIJW-ONUALHDOSA-L- 分子式
- C58H80Cl2N2O14
- 平均分子量
- 1,100.2 g/mol
- 単同位体質量
- 1,098.4986606
概要
Mivacurium chloride is a member of isoquinolines.
名称と識別子
- 優先名称
- Mivacurium Chloride
- IUPAC
- bis[3-[(1R)-6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propyl] (E)-oct-4-enedioate dichloride
- 現地名
- ミバクリウムクロリド
- 英語名
- Mivacurium chloride
- 分子式
- C58H80ClN2O14+
- 分子量
- 1064.73
名称と別名
MIVACURIUM CHLORIDE106861-44-3MivacronCloruro de mivacurioChlorure de mivacuriumBW B109OU dichlorideMivacurii chloridumDTXSID5046649BWB109OUMIVACRON IN DEXTROSE 5% IN PLASTIC CONTAINERBW-B109OU DICHLORIDEBW-1090U DICHLORIDE
名称をさらに表示
ミバクリウムクロリド塩化ミバクリウムミバクリウムクロリド (MIXTURE OF ISOMERS)(1R,1′R)-2,2′-[[(E)-1,8-ジオキソ-4-オクテン-1,8-ジイル]ビス(オキシ-3,1-プロパンジイル)]ビス[1,2,3,4-テトラヒドロ-6,7-ジメトキシ-2-メチル-1-[(3,4,5-トリメトキシフェニル)メチル]イソキノリニウム]・ジクロリドMikuronium chloride(S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinolineBW-B1090Urac-Mivacronrac-BW-B 1090rac-BW-B 1090ULomiwa ReservoirBMS-512148 (2S)-1
DTXCID3026649600ZG213C3RefChem:56875M03AC10MIVACURIUM DICHLORIDEBW-B 1090UMivacurium (dichloride)bis[3-[(1R)-6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propyl] (E)-oct-4-enedioate;dichloride
物性
構造計算による物性
- 極性表面積
- 145 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 16
- 回転可能結合数
- 30
- 重原子数
- 76
- 形式電荷
- 0
- 複雑度
- 1,550
実験および物理化学的性質
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
物理化学的性質
- 比旋光度
- 20 D · 20D -62.7° (c = 1.9 in water)
- 貯蔵温度
- -20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
- 溶解性
- DMSO: Soluble; Water: Soluble
- 外見
- A solid
- 色
- White to off-white
- 安定性
- Hygroscopic
- InChIKey
- KFWHZSUNFAPZPW-NVIAPQDINA-M
化学的性質
化学的特性Off-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
Danger
H301 (96.2%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 53 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 3 (96.2%)
毒性情報
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Mivacurium chloride
vNo-DILI-concern
0
No match
DOI:10.1016/j.drudis.2016.02.015
安全データ
- 危険有害性情報
- コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H301
化学と産業
薬理情報
ATC Code
M03AC10
M - Musculo-skeletal system
QM - Musculo-skeletal system
MeSH Pharmacological Classification
Drugs that interrupt transmission at the skeletal neuromuscular junction without causing depolarization of the motor end plate. They prevent acetylcholine from triggering muscle contraction and are used as muscle relaxants during electroshock treatments, in convulsive states, and as anesthesia adjuvants.
用途と製造
UsesUse (kg; approx.) in Germany (2009): >10
応用分野
説明Mivacurium chloride,a mixture of three stereoisomers, is an intravenously administered, short-acting skeletal muscle relaxant introduced as an adjunct to general anesthesia. Structurally mivacurium chloride is closely related to doxacurium chloride introduced in 1991 by Wellcome as a muscle relaxant. It is a nondepolarizing neuromuscular blocking agent reportedly with a shorter duration of action and a more rapid rate of spontaneous recovery than other nondepolarizing agents. In extensive clinical trials mivacurium chloride was well tolerated with few side effects.
使用Non-depolarizing neuromuscular blocking agent. Muscle relaxant (skeletal)
一般的な説明Mivacurium chloride, 1,2,3,4-tetrahydro-2-(3-hydroxypropyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)isoquinolinium chloride, (E)-4-octandioate (Mivacron), is a mixture of three stereoisomers,the trans-trans, cis-trans, and cis-cis diesters, each ofwhich has neuromuscular blocking properties. The cis-cisisomer is about one tenth as potent as the other isomers.Mivacurium chloride is a short-acting nondepolarizing drugused as an adjunct to anesthesia to relax skeletal muscle.The drug is hydrolyzed by plasma esterases, and it is likelythat anticholinesterase agents used as antidotes could prolongrather than reverse the effects of the drug.
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