기본 정보
- CAS
63939-65-1- 표준 SMILES
C[N+](C)(C)CC#CCN1CCCC1=O- InChIKey
CANZROMYQDHYHR-UHFFFAOYSA-N- 분자식
- C11H19N2O+
- 평균 분자량
- 195.28 g/mol
- 단동위원소 질량
- 195.14973823
개요
Oxotremorine M is a quaternary ammonium ion. It has a role as a muscarinic agonist.
이름 및 식별자
- 우선 이름
- N,N,N-Trimethyl-4-(2-oxo-1-pyrrolidinyl)-2-butyn-1-aminium
- IUPAC
- trimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]azanium
- 현지명
- 옥소트레모린M
- 영어명
- OXOTREMORINE M
- 분자식
- C11H19N2O+
- 분자량
- 195.29
이름 및 동의어
63939-65-1N,N,N-trimethyl-4-(2-oxopyrrolidin-1-yl)but-2-yn-1-aminiumVWS78J9ZUJN,N,N-Trimethyl-4-(2-oxo-1-pyrrolidinyl)-2-butyn-1-aminium2-Butyn-1-aminium, N,N,N-trimethyl-4-(2-oxo-1-pyrrolidinyl)-CHEBI:38322RefChem:857807Oxotremorine Moxotremorine-Mtrimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]azaniumCHEMBL23957[3H]oxotremorine-M
이름 더 보기
옥소트레모린MOXOTREMORINE METHIODIDEOXOTREMORINE M (OXOTREMORINE METHIODTrimethyl[4-(2-oxo-1-pyrrolidinyl)-2-butynyl]aminiumN,N,N-Trimethyl-4-(2-oxopyrrolidin-1-yl)-2-butyn-1-aminiumN,N,N-Trimethyl-4-(2-oxo-1-pyrolidinyl)-2-butyn-1-ammoniumiodideN,N,N-TRIMETHYL-4-(2-OXO-1-PYRROLIDINYL)-2-BUTYN-1-AMMONIUM IODIDEOxotremorine methiodide, N,N,N,-Trimethyl-4-(2-oxo-1-pyrrolidinyl)-2-butyn-1-ammonium iodide
Spectrum_001982Tocris-1067OXO-MLopac-O-100UNII-VWS78J9ZUJLopac0_000954GTPL303KBioSS_002548
물성
구조 계산 물성
- XLogP
- -0.1
- 극성 표면적
- 20.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 14
- 형식 전하
- 1
- 복잡도
- 277
물리화학적 성질
- 저장 조건
- 2 · 2-8°C
- 용해도
- 2 O: · H2O: 24 mg/mL
- 물리적 상태
- 고체
- 색상
- 하얀색
- 수용성
- 2 O: · H2O: 24mg/mLethanol: 4.6mg/mL
- InChI
- 1S/C11H19N2O.HI/c1-13(2,3)10-5-4-8-12-9-6-7-11(12)14;/h6-10H2,1-3H3;1H/q+1;/p-1
- InChIKey
- VVLMSCJCXMBGDI-UHFFFAOYSA-M
- SMILES
- [I-].C[N+](C)(C)CC#CCN1CCCC1=O
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H300+H310+H330 (100%): Fatal if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P260, P262, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P320, P321, P330, P361+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 2 (100%)
안전 데이터
- wgk
- 3
- rtecs
- ER9552000
- ridadr
- UN 2810 6.1/PG 2
- risk_code
- 26/27/28
- hazard_code
- T+
- safety_code
- 22-24/25-45-36/37/39-28
- Hazard Classifications
- Acute Tox. 1 InhalationAcute Tox. 2 DermalAcute Tox. 2 Oral
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
약리 정보
MeSH Pharmacological Classification
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.
응용 분야
용도Oxotremorine M is a small molecule agonist of muscarinic receptors.
공급사8 곳
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…