ドブタミン

Dobutamine

HCID 36811CAS 34368-04-2

基本情報

標準SMILES
CC(CCc1ccc(O)cc1)NCCc1ccc(O)c(O)c1
InChIKey
JRWZLRBJNMZMFE-UHFFFAOYSA-N
分子式
C18H23NO3
平均分子量
301.4 g/mol
単同位体質量
301.1677936

名称と識別子

優先名称
Dobutamine
IUPAC
4-[2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol
現地名
ドブタミン
英語名
Dobutamine
分子式
C18H23NO3
分子量
301.38

名称と別名

dobutamine34368-04-2DL-dobutamineDobutaminaracemic-DobutamineRacemic dobutamineDobutaminumrac-dobutamineCompound 81929DTXSID30229584-[2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol4-(2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)benzene-1,2-diol
名称をさらに表示
rac-4-[2-[[(R*)-3-(4-ヒドロキシフェニル)-1-メチルプロピル]アミノ]エチル]-1,2-ベンゼンジオール(±)-ドブタミン化合物81929rac-4-[2-[[(R*)-3-(p-ヒドロキシフェニル)-1-メチルプロピル]アミノ]エチル]ピロカテコールdl-ドブタミンドブタミンDOBUTAMINE HCLobutamineDOBUTAMINE USP/EP/BPDOBUTAMINE HYDROCHLORIDE USPRacemic dobutamine hydrochloride monomer
COMPOUND-81929(+-)-4-(2-((3-(p-Hydroxyphenyl)-1-methylpropyl)amino)ethyl)pyrocatecholCHEBI:4670DTXCID7029583S12J473723,4-dihydroxy-N-[3-(4-hydroxyphenyl)-1-methylpropyl]-beta-phenylethylamine4-{2-[3-(4-Hydroxy-phenyl)-1-methyl-propylamino]-ethyl}-benzene-1,2-diol1,2-Benzenediol, 4-(2-((3-(4-hydroxyphenyl)-1-methylpropyl)amino)ethyl)-, (+-)-

データベース識別子

CAS
34368-04-2
PubChem CID
36811
DTXSID
DTXSID3022958
ChEMBL
CHEMBL926
ChEBI
CHEBI:4670
UNII
3S12J47372
EC Number
112-679-1
Nikkaji
J29.869G、J399.069I

物性

構造計算による物性

XLogP
3.4
極性表面積
72.7 Ų
水素結合供与体数
4
水素結合受容体数
4
回転可能結合数
7
重原子数
22

物理化学的性質

沸点
527.7 · 527.7±50.0 °C(Predicted)
比重(密度)
1.189 · 1.189±0.06 g/cm3(Predicted)
貯蔵温度
2 · 2-8°C
酸解離定数(Pka)
9.65 · 9.65±0.10(Predicted)

安全と法規制

安全データ

wgk
3
risk_code
20/21/22-63
hazard_code
Xn
safety_code
22-26-36/37/39

化学と産業

応用分野 · 1 件

使用Dobutamine is predominantly a β1-agonist, with some activity at β2- receptors. Its primary effect is an increase in cardiac output as a consequence of increased contractility and HR and decreased afterload. Systolic arterial pressure may therefore increase, but peripheral resistance is reduced or unchanged. It is primarily used as an inotrope (inodilator) in low CO states. D obutamine increases SA node automaticity and conduction velocity in the atria, ventricles and AV node, with tachyarrhythmias occurring at higher doses. Dobutamine is administered as an i.v. infusion at a dose range of 0.5– 40 μg kg–1 min–1.

サプライヤー30 社

北京华美互利生物化工010-56205725 · [email protected]
武汉布林科技有限公司3456065315 13260619011 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
Syntechem Co.,Ltd[email protected]
United Life Science020-82099279 18988941402 · [email protected]
補足説明 · 1 件

定義ChEBI: A catecholamine that is 4-(3-aminobutyl)phenol in which one of the hydrogens attached to the nitrogen is substituted by a 2-(3,4-dihydroxyphenyl)ethyl group. A beta1-adrenergic receptor agonist that has cardiac stimulan action without evoking vasoconstriction or tachycardia, it is used as the hydrochloride to increase the contractility of the heart in the management of acute heart failure.

関連反応

2 件

関連ノート

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