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Rivastigmine Tartrate

HCID 6918078
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
129101-54-8
표준 SMILES
CCN(C)C(=O)Oc1cccc([C@H](C)N(C)C)c1.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIKey
GWHQHAUAXRMMOT-MBANBULQSA-N
분자식
C18H28N2O8
평균 분자량
400.4 g/mol
단동위원소 질량
400.18456586

개요

Rivastigmine tartrate is a tartrate salt obtained by reaction of rivastigmine with one equivalent of (R,R)-tartaric acid. A reversible cholinesterase inhibitor. It has a role as an EC 3.1.1.8 (cholinesterase) inhibitor, a cholinergic drug and a neuroprotective agent. It contains a rivastigmine(1+).

이름 및 식별자

우선 이름
Rivastigmine Tartrate
IUPAC
(2R,3R)-2,3-dihydroxybutanedioic acid;[3-[(1S)-1-(dimethylamino)ethyl]phenyl] N-ethyl-N-methylcarbamate
영어명
Rivastigmine tartrate
분자식
C18H28N2O8
분자량
400.42

이름 및 동의어

Rivastigmine tartrate129101-54-8Rivastigmine Hydrogen TartrateRivastigmine bitartrateENA 713SDZ-ENA 713Rivastigmine hydrogentartrateRivastigmine actavis9IY2357JPECarbamic acid, N-ethyl-N-methyl-, 3-[(1S)-1-(dimethylamino)ethyl]phenyl ester, (2R,3R)-2,3-dihydroxybutanedioate (1:1)CHEBI:64358CARBAMIC ACID, N-ETHYL-N-METHYL-, 3-((1S)-1-(DIMETHYLAMINO)ETHYL)PHENYL ESTER, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE (1:1)
이름 더 보기
CS-118Rivastigimine tartrateS-Rivastigmine tartraterivastigMine ditartrateRivastigMine L-TartrateRivastigmine-d6 tartarate
DTXCID4027818RefChem:56915Carbamic Acid, Ethylmethyl-, 3-((1S)-1-(dimethylamino)ethyl)phenyl Ester,(2R,3R)-2,3-dihydroxybutanedioate(1:1)DTXSID8047840ENA-713Rivastigmine (tartrate)(S)-3-(1-(Dimethylamino)ethyl)phenyl ethyl(methyl)carbamate (2R,3R)-2,3-dihydroxysuccinateMFCD03700731

데이터베이스 식별자

물성

구조 계산 물성

극성 표면적
148 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
9
회전 가능 결합 수
8
무거운 원자 수
28
형식 전하
0
복잡도
402

실험 및 물리화학적 성질

Human Drugs · 3건

FDA approved drugs -> Active ingredient

EMA approved medicines: Human medicine

FDA approved drugs -> Active ingredient

물리화학적 성질

녹는점
123 · 123-1250C
저장 조건
2 · 2-8°C
용해도
2 O: · H2O: 용해성15mg/mL, 투명
물리적 상태
가루
색상
흰색에서 베이지색
수용성
2 O: · H2O: 15mg/mL, clear
InChI
InChI=1/C14H22N2O2.C4H6O6/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4;5-1(3(7)8)2(6)4(9)10/h7-11H,6H2,1-5H3;1-2,5-6H,(H,7,8)(H,9,10)/t11-;1-,2-/s3
InChIKey
GWHQHAUAXRMMOT-AAUFCPPMNA-N
SMILES
C1(=CC=CC([C@H](C)N(C)C)=C1)OC(=O)N(C)CC.[C@H](O)(C(=O)O)[C@@H](O)C(=O)O |&1:5,18,23,r|

화학적 성질

White to Off-White Powder

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Danger

H300 (90%): Fatal if swallowed [Danger Acute toxicity, oral]

P260, P261, P264, P270, P271, P273, P301+P316, P304+P340, P319, P321, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 10 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationRivastigmine tartrate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 2 (90%)

독성 정보

Drug Induced Liver Injury · 6건

Drug Induced Liver Injury Rank (DILIrank 2.0)

Rivastigmine tartrate

vLess-DILI-concern

3

Adverse reactions

DOI:10.1016/j.drudis.2016.02.015

안전 데이터

wgk
3
rtecs
FA9550000
ridadr
UN 2811 6.1 / PGII
HS 번호
29242990
포장분류
III
위험 등급
6.1
Hazard Classifications
Acute Tox. 2 OralAquatic Chronic 2
스토리지 클래스
6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

화학 및 산업

약리 정보

FDA Pharmacological Classification · 2건

RIVASTIGMINE TARTRATE

Cholinesterase Inhibitors [MoA]; Cholinesterase Inhibitor [EPC]

MeSH Pharmacological Classification · 2건

Drugs that inhibit cholinesterases. The neurotransmitter ACETYLCHOLINE is rapidly hydrolyzed, and thereby inactivated, by cholinesterases. When cholinesterases are inhibited, the action of endogenously released acetylcholine at cholinergic synapses is potentiated. Cholinesterase inhibitors are widely used clinically for their potentiation of cholinergic inputs to the gastrointestinal tract and urinary bladder, the eye, and skeletal muscles; they are also used for their effects on the heart and the central nervous system.

Drugs intended to prevent damage to the brain or spinal cord from ischemia, stroke, convulsions, or trauma. Some must be administered before the event, but others may be effective for some time after. They act by a variety of mechanisms, but often directly or indirectly minimize the damage produced by endogenous excitatory amino acids.

응용 분야

용도Rivastigmine Tartrate, a cholinesterase inhibitor with IC50 of 5.5 μM, ues as a parasympathomimetic or cholinergic agent for the treatment of mild to moderate Alzheimer disease.

일반 설명Pharmaceutical secondary standards for application in quality control provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards

공급사120 곳

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CAS
129101-54-8
PubChem CID
6918078
ChEMBL
CHEMBL1201092
ChEBI
CHEBI:64358
UNII
9IY2357JPE
EC Number
603-318-3
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추가 설명

정의ChEBI: A tartrate salt obtained by reaction of rivastigmine with one equivalent of (R,R)-tartaric acid. A reversible cholinesterase inhibitor.