필로카르핀질산염

Pilocarpine Nitrate

HCID 657349CAS 148-72-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC[C@@H]1C(=O)OC[C@@H]1Cc1cncn1C.O=[N+]([O-])O
InChIKey: PRZXEPJJHQYOGF-GNAZCLTHSA-N
분자식: C11H17N3O5
평균 분자량: 271.27 g/mol
단동위원소 질량: 271.11682064

개요

See also: Pilocarpine (has active moiety); Pilocarpine Hydrochloride (related).

이름 및 식별자

우선 이름: Pilocarpine Nitrate
IUPAC: (3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;nitric acid
현지명: 필로카르핀질산염
영어명: Pilocarpine nitrate
분자식: C11H17N3O5
분자량: 271.27

이름 및 동의어

Pilocarpine nitrate148-72-1PilaganPilocarpine mononitratePilocarpini nitrasPilocarpinum nitricumPilocarpine subnitrateNSC-757282M20T465H6JPilocarpine nitrate (USP)Pilocarpine nitrate [USP]2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, (3S-cis)-, mononitrate

이름 더 보기

필로카르핀질산염NitratPilocarpine nitrate for system suitability CRSPilocarpinnitratEinecs 205-723-7Pilocarpin Nitratep.v.carpineliquifilm

2(3H)-Furanone, 3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-, (3S,4R)-, mononitratePiloc nitRefChem:863282205-723-7Pilocarpine (nitrate)PilofrinPilocarpine nitrate salt(3S,4R)-3-Ethyl-4-((1-methyl-1H-imidazol-5-yl)methyl)dihydrofuran-2(3H)-one nitrate

데이터베이스 식별자

CAS: 148-72-1
PubChem CID: 657349
DTXSID: DTXSID80883277
ChEMBL: CHEMBL1213136
UNII: M20T465H6J
EC Number: 205-723-7

물성

구조 계산 물성

극성 표면적: 110 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 3
무거운 원자 수: 19
형식 전하: 0
복잡도: 269

실험 및 물리화학적 성질

Collision Cross Section146.4 Å² [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점: 173 · 173,5-174°C
굴절률: 81 ° · 81 ° (C=2, H2O)
저장 조건: 2 · 2-8°C
용해도: 2 O: · H2O: 0.1 g/mL, 투명, 매우 희미한 노란색
물리적 상태: 가루
색상: 하얀색
수용성: 2 O: · H2O: 100mg/mL
Merck: 14 · 14,7424
BRN: 4171406 · 4171406
주요 응용: 의약품(소분자)
InChI: 1S/C11H16N2O2.HNO3/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2;2-1(3)4/h5,7-8,10H,3-4,6H2,1-2H3;(H,2,3,4)/t8-,10-;/m0./s1
InChIKey: PRZXEPJJHQYOGF-GNAZCLTHSA-N
SMILES: O[N+]([O-])=O.CC[C@H]1[C@H](COC1=O)Cc2cncn2C
EPA: Pilocarpine nitrate (148-72-1)

화학적 성질

White or almost white, crystalline powder or colourless crystals, sensitive to light.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H300 (99.1%): 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 113 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationPilocarpine nitrate: 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]-, (3S-cis)-, mononitrate: Environment tier I assessment

Hazard Classes and CategoriesAcute Tox. 2 (99.1%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: TK1455000
ridadr: 3087
독성: LD50 oral in rat: 911mg/kg
HS 번호: 2939800000
risk_code: 22-26/28
hazard_code: Xn,T+
safety_code: 1-25-45
포장분류: III
위험 등급: 6.1(b)
F 고인화성물질: 3-10
Hazard Classifications: Acute Tox. 2 InhalationAcute Tox. 4 OralOx. Sol. 2
스토리지 클래스: 5.1B - Oxidizing hazardous materials

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

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

General Manufacturing Information2(3H)-Furanone, 3-ethyldihydro-4-[(1-methyl-1H-imidazol-5-yl)methyl]-, (3S,4R)-, nitrate (1:1): INACTIVE

응용 분야 · 2건

용도Pilocarpine nitrate salt has been used to measure bronchoconstriction and M2 and M3 muscarinic receptor function in vivo. It has also been used to induce electrographic and behavioral seizures and to study the different patterns of neuronal activation and neurodegeneration in Proechimys rats and Wistar rats.

일반 설명Pilocarpine mononitrate occursas shining white crystals that are not hygroscopic butare light sensitive. It is soluble in water (1:4) and alcohol(1:75) but insoluble in chloroform and ether. Aqueoussolutions are slightly acid to litmus and may be sterilizedin the autoclave. The alkaloid is incompatible with alkalies,iodides, silver nitrate, and reagents that precipitatealkaloids.

상·하류 제품 정보

상류 원료

필로카르핀 질산

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

成都健腾生物技术有限公司028-85159085 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

LGM Pharma1-(800)-881-8210 · [email protected]

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