기본 정보
- CAS
54-71-7- 표준 SMILES
CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C.Cl- InChIKey
RNAICSBVACLLGM-GNAZCLTHSA-N- 분자식
- C11H17ClN2O2
- 평균 분자량
- 244.72 g/mol
- 단동위원소 질량
- 244.09785546
개요
Pilocarpine hydrochloride is the hydrochloride salt of (+)-pilocarpine, a medication used to treat increased pressure inside the eye and dry mouth. It contains a (+)-pilocarpine.
이름 및 식별자
- 우선 이름
- Pilocarpine Hydrochloride
- IUPAC
- (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;hydrochloride
- 영어명
- (+)-Pilocarpine hydrochloride
- 분자식
- C11H17ClN2O2
- 분자량
- 244.72
이름 및 동의어
Pilocarpine hydrochloride54-71-7Pilocarpine HClSalagenPilocarpine monohydrochlorideSno piloIsopto carpineVistacarpin NPILOPINE HSPilopineQLOSIVUITY
이름 더 보기
(3S,4R)-4,5-DIHYDRO-3-ETHYL-4-(1-METHYL-1H-IMIDAZOL-5-YLMETHYL)-2(3H)-FURANONE HYDROCHLORIDESanpilopilocarpilocel(3S,4R)-Akarpineami-pilo
Pilocarpinum muriaticum0WW6D218XJNSC5746CHEBI:141029Pilocarpini hydrochloridumDTXSID2041096(3S,4R)-3-ethyl-4-((1-methyl-1H-imidazol-5-yl)methyl)dihydrofuran-2(3H)-one hydrochloride2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, monohydrochloride, (3S,4R)-
데이터베이스 식별자
- CAS
54-71-7- PubChem CID
- 5909
- DTXSID
DTXSID2041096- ChEMBL
CHEMBL1200330、CHEMBL611494- ChEBI
CHEBI:141029- UNII
- 0WW6D218XJ
물성
구조 계산 물성
- 극성 표면적
- 44.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 245
실험 및 물리화학적 성질
Solubility>36.7 [ug/mL] (The mean of the results at pH 7.4)
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
물리화학적 성질
- 녹는점
- 202 · 202-205 °C(lit.)
- 저장 조건
- 2 · 2-8°C
- 용해도
- 2 O: · H2O: 100 mg/mL
- 물리적 상태
- 가루
- 색상
- 하얀색
- 수용성
- 녹는
- Merck
- 14 · 14,7424
- BRN
- 4034491 · 4034491
- 안정성
- 흡습성
- 주요 응용
- 법의학 및 독성학수의사
- InChI
- 1S/C11H16N2O2.ClH/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2;/h5,7-8,10H,3-4,6H2,1-2H3;1H/t8-,10-;/m0./s1
- InChIKey
- RNAICSBVACLLGM-GNAZCLTHSA-N
- SMILES
- Cl.CC[C@H]1[C@H](COC1=O)Cc2cncn2C
- LogP
- -0.095 · -0.095 (est)
- EPA
- Pilocarpine monohydrochloride (54-71-7)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H300 (64.2%): Fatal if swallowed [Danger Acute toxicity, oral]
P260, P264, P270, P271, P284, P301+P316, P304+P340, P316, P320, P321, P330, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 123 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationPilocarpine hydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 2(3H)-Furanone, 3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-, monohydrochloride, (3S-cis)-: Human health tier I assessment
Hazard Classes and CategoriesAcute Tox. 2 (64.2%)
독성 정보
Treatment
Overdosage should be treated with atropine titration (0. 5 mg to 1. 0 mg given subcutaneously or intravenously) and supportive measures to maintain respiration and circulation. Epinephrine (0. 3 mg to 1. 0 mg, subcutaneously or intramuscularly) may also be of value in the presence of severe cardiovascular depression or bronchoconstriction. (L1712)
Exposure RoutesOral ; eye contact. There was a decrease in the rate of absorption of pilocarpine from SALAGEN Tablets when taken with a high fat meal by 12 healthy male volunteers
Toxicity Summary
Pilocarpine is a cholinergic parasympathomimetic agent. It increase secretion by the exocrine glands, and produces contraction of the iris sphincter muscle and ciliary muscle (when given topically to the eyes) by mainly stimulating muscarinic receptors.
화학 및 산업
약리 정보
Metabolism/MetabolitesPossibly occurs at the neuronal synapses and in the plasma
Half Life: 0.76 hours
FDA Pharmacological Classification
PILOCARPINE HYDRCHLORIDE
Cholinergic Agonists [MoA]; Cholinergic Receptor Agonist [EPC]; Cholinergic Muscarinic Agonists [MoA]
PILOCARPINE HYDROCHLORIDE
Cholinergic Agonists [MoA]; Cholinergic Receptor Agonist [EPC]; Cholinergic Muscarinic Agonists [MoA]
PILOCARPINE HYDROCHLORIDE OPHTHALMIC SOLUTION
Cholinergic Muscarinic Agonists [MoA]; Cholinergic Receptor Agonist [EPC]; Cholinergic Agonists [MoA]
MeSH Pharmacological Classification
Agents causing contraction of the pupil of the eye. Some sources use the term miotics only for the parasympathomimetics but any drug used to induce miosis is included here.
Drugs that bind to and activate muscarinic cholinergic receptors (RECEPTORS, MUSCARINIC). Muscarinic agonists are most commonly used when it is desirable to increase smooth muscle tone, especially in the GI tract, urinary bladder and the eye. They may also be used to reduce heart rate.
용도 및 제조
UsesFor the treatment of radiation-induced dry mouth (xerostomia) and symptoms of dry mouth in patients with Sjögrens syndrome.
General Manufacturing Information2(3H)-Furanone, 3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-, hydrochloride (1:1), (3S,4R)-: ACTIVE
응용 분야
용도(+)-Pilocarpine hydrochloride is a muscarinic M1 and M2 acetylcholine receptor agonist with pKB values of 5 and 3.7, respectively. Systemic administration of (+)-Pilocarpine hydrochloride is typically used as an animal model for temporal lobe epilepsy and can mimic the generation of complex partial seizures by producing changes in hippocampal neuron morphology, membrane properties, and synaptic responses.
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