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기본 정보
- CAS
136310-93-5- 표준 SMILES
C[N+]1(C)[C@@H]2CC(OC(=O)C(O)(c3cccs3)c3cccs3)C[C@H]1[C@@H]1O[C@@H]12.[Br-]- InChIKey
DQHNAVOVODVIMG-RGECMCKFSA-M- 분자식
- C19H22BrNO4S2
- 평균 분자량
- 472.426 g/mol
- 단동위원소 질량
- 471.01736228
이름 및 식별자
- 우선 이름
- Tiotropium bromide
- IUPAC
- (1R,2R,4S,5S)-7-{[Hydroxydi(thiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium bromide
- 영어명
- Tiotropium bromide
- 분자식
- C19H22BrNO4S2
- 분자량
- 472.42
이름 및 동의어
SpirivaTiotropiuM broMide anhydrous(1α,2β,4β,5α,7β)-7-[(Hy-droxydi-2-thienylacetyl)axy]-9,9-dimethyl-3-oxa-9-azoniatri-cyclo[3.3.1.02.4]nonane(1a,2b,4b,5a,7b)-7-[(Hydroxydi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide(1a,2,4,5a,7)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane Bromide(1R,2R,4S,5S,7s)-7-(2-Hydroxy-2,2-di(thiophen-2-yl)acetoxy)-9,9-diMethyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-9-iuM broMide(1R,2R,4S,5S,7s)-7-[(2-Hydroxy-2,2-dithiophen-2-ylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide monohydrateTiovaBa-679BA 79BR
데이터베이스 식별자
- CAS
136310-93-5- PubChem CID
- 5487426
- DTXSID
DTXSID2044214- ChEMBL
CHEMBL3189058、CHEMBL4440620- ChEBI
CHEBI:90959- UNII
- XX112XZP0J
물성
물리화학적 성질
- 녹는점
- 218 · 218-2200C
- 저장 조건
- 2 · Inert atmosphere,2-8°C
- 용해도
- DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
- Merck
- 14 · 14,9454
- InChIKey
- DQHNAVOVODVIMG-FOGIBKMMNA-M
- SMILES
- C(O)(C(=O)O[C@@H]1C[C@@]2([H])[N+](C)(C)[C@]([H])([C@H]3[C@@H]2O3)C1)(C1SC=CC=1)C1SC=CC=1.[Br-] |&1:5,7,12,14,15,r|
화학적 성질
White Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- HS 번호
- 2942.00.0500
화학 및 산업
응용 분야
개요Tiotropium is an antagonist that binds to M1, M2, and M3 muscarinic acetylcholine receptors (Kds = 0.43, 0.54, and 0.69 nM, respectively, for human receptors). It decreases acetylcholine-induced contraction of isolated guinea pig trachea in a concentration-dependent manner. In vivo, tiotropium (1 g/L inhaled aerosol) confers complete protection against acetylcholine-induced bronchospasms in anesthetized dogs. Formulations containing tiotropium have been used in the treatment of chronic obstructive pulmonary disease (COPD).
용도Muscarinic receptor antagonist. Bronchodilator
일반 설명Tiotropium bromide, (1 ,2 ,4 ,7 )-7-[(hydroxidi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane, (Spiriva) is anantimuscarinic agent that is used in an inhalation device to deliverthe drug into the lungs. It is indicated in the treatment ofchronic obstructive pulmonary disease (COPD), includingchronic bronchitis and emphysema. The standard once-dailydose is 18 g of tiotropium.
상·하류 제품 정보
상류 원료
공급사100 곳
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
烟台宇晨生物医药有限公司0535-7295056 15692356085 · [email protected]
合肥翰刚医药科技有限公司
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