기본 정보
- CAS
144-44-5- 표준 SMILES
C[N+]1(CCCCC[N+]2(C)CCCC2)CCCC1- InChIKey
XSBSKEQEUFOSDD-UHFFFAOYSA-N- 분자식
- C15H32N2+2
- 평균 분자량
- 240.43 g/mol
- 단동위원소 질량
- 240.25654903
개요
Pentolinium ion is a dication whose structure comprises a pentane backbone linking two 1-methylpyrrolidinium groups; a nicotinic antagonist used as a ganglionic blocking agent in hypertension. It contains a pyrrolidinium ion.
이름 및 식별자
- 우선 이름
- Pentolinium
- IUPAC
- 1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-ium
- 현지명
- 1,1'-(펜타메틸렌)비스(1-메틸피롤리디늄)
- 영어명
- 1,1'-(Pentamethylene)bis(1-methylpyrrolidinium)
- 분자식
- C15H32N2+2
- 분자량
- 240.43
이름 및 동의어
PentoliniumPentoloniumPentolonumpentolineumpentolinium ion144-44-5Pentolinium cation1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-iumULL76WPU5XDTXSID5048554CHEBI:3474011-methyl-1-(5-(1-methylpyrrolidin-1-ium-1-yl)pentyl)pyrrolidin-1-ium
이름 더 보기
1,1'-(펜타메틸렌)비스(1-메틸피롤리디늄)1,1'-Pentamethylenebis(1-methylpyrrolidinium)1,1'-(Pentamethylene)bis(1-methylpyrrolidinium)1,1'-(Pentamethylene)bis(1-methylpyrrolidine-1-ium)1,1'-(1,5-Pentanediyl)bis(1-methylpyrrolidin-1-ium)
RefChem:860063DTXCID50281101,1'-(1,5-Pentanediyl)bis(1-methylpyrrolidinium)1,1'-pentane-1,5-diylbis(1-methylpyrrolidinium)UNII-ULL76WPU5XCHEMBL1271PENTOLONIUM [WHO-DD]1,1/'-(Pentamethylene)bis(1-methylpyrrolidinium)
데이터베이스 식별자
- CAS
144-44-5、52-62-0- PubChem CID
- 5850
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 17
- 형식 전하
- 2
- 복잡도
- 201
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
Solubility1.16e-05 g/L
Melting Point213 °C (tartrate salt)
Physical DescriptionSolid
화학 및 산업
약리 정보
PharmacodynamicsPentolinium acts as a ganglionic blocking agent. Pentolinium inhibits release of adrenaline and noradrenaline from adrenergic nerves. It is used as an antihypertensive, and can be administered orally, intramuscularly, and subcutaneously.
Mechanism of Action
Pentolinium binds to the nicotinic (ganglion) acetylcholine receptor. This receptor/channel is permeable to a range of divalent cations including calcium, the influx of which may activate a potassium current which hyperpolarizes the cell membrane. Blockage of the receptor leads to smooth muscle relaxation and vasodilaton.
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Agents having as their major action the interruption of neural transmission at nicotinic receptors on postganglionic autonomic neurons. Because their actions are so broad, including blocking of sympathetic and parasympathetic systems, their therapeutic use has been largely supplanted by more specific drugs. They may still be used in the control of blood pressure in patients with acute dissecting aortic aneurysm and for the induction of hypotension in surgery.
Drugs that bind to nicotinic cholinergic receptors (RECEPTORS, NICOTINIC) and block the actions of acetylcholine or cholinergic agonists. Nicotinic antagonists block synaptic transmission at autonomic ganglia, the skeletal neuromuscular junction, and at central nervous system nicotinic synapses.
Cellular LocationsMembrane
추가 설명
정의ChEBI: A dication whose structure comprises a pentane backbone linking two 1-methylpyrrolidinium groups; a nicotinic antagonist used as a ganglionic blocking agent in hypertension.
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…