기본 정보
- CAS
2508-79-4- 표준 SMILES
CCOC(=O)[C@@](C)(N)Cc1ccc(O)c(O)c1.Cl- InChIKey
QSRVZCCJDKYRRF-YDALLXLXSA-N- 분자식
- C12H18ClNO4
- 평균 분자량
- 275.73 g/mol
- 단동위원소 질량
- 275.0924357
개요
Methyldopate Hydrochloride is the hydrochloride salt form of methyldopa, a phenylalanine derivate and aromatic amino acid decarboxylase inhibitor with antihypertensive activity. Methyldopa is a prodrug and is metabolized in the central nervous system. The antihypertensive action of methyldopa seems to be attributable to its conversion into alpha-methylnorepinephrine, which is a potent alpha-2 adrenergic agonist that binds to and stimulates potent central inhibitory alpha-2 adrenergic receptors. This results in a decrease in sympathetic outflow and decreased blood pressure.
이름 및 식별자
- 우선 이름
- Methyldopate Hydrochloride
- IUPAC
- ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate;hydrochloride
- 현지명
- 에틸메틸도페이트염산염
- 영어명
- Ethyl methyldopate hydrochloride
- 분자식
- C12H17NO4.ClH
- 분자량
- 275.73
이름 및 동의어
METHYLDOPATE HYDROCHLORIDE2508-79-4Methyldopate HCLMethyldopa ethyl ester hydrochlorideAldomet Ester hydrochlorideDTXSID1045370EINECS 219-720-3UNII-7PX435DN5A7PX435DN5ANSC-760088L-3-(3,4-Dihydroxyphenyl)-2-methylalanine ethyl ester hydrochlorideMethyldopa l-form ethyl ester hydrochloride
이름 더 보기
에틸메틸도페이트염산염METHYLDOPAETHYLHCLEthyl ester hydrochlorideQSRVZCCJDKYRRF-YDALLXLXSA-Nmethyldopa ethyl hydrochlorideEthyl methyldopa hydrochlorideethyl methyldopate hydrochlorideMethyldopate Hydrochloride (200 mg)
DTXCID9025370Methyldopate hydrochloride [USAN:USP]NSC 760088L-Tyrosine, 3-hydroxy-alpha-methyl-, ethyl ester, hydrochlorideMethyldopate hydrochloride (USAN:USP)METHYLDOPATE HYDROCHLORIDE (MART.)METHYLDOPATE HYDROCHLORIDE [MART.]METHYLDOPATE HYDROCHLORIDE (USP-RS)
데이터베이스 식별자
물성
구조 계산 물성
- 극성 표면적
- 92.8 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 271
실험 및 물리화학적 성질
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
물리화학적 성질
- 저장 조건
- 2 · 2-8°C
- 물리적 상태
- crystalline powder
- 주요 응용
- 제약소분자 약용
- InChI
- 1S/C12H17NO4.ClH/c1-3-17-11(16)12(2,13)7-8-4-5-9(14)10(15)6-8;/h4-6,14-15H,3,7,13H2,1-2H3;1H/t12-;/m0./s1
- InChIKey
- QSRVZCCJDKYRRF-YDALLXLXSA-N
- SMILES
- [Cl-].N[C@](Cc1cc(c(cc1)O)O)(C)C(=O)OCC.[H+]
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 3
- HS 번호
- 2922504500
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Ethyl methyldopate hydrochloride is Antihypertensive.
일반 설명Methyldopatehydrochloride, L-3-(3,4-dihydroxyphenyl)-2-methylalanineethyl ester hydrochloride (Aldomet ester hydrochloride), α-methyldopa, lowers blood pressure by inhibitingthe outflow of sympathetic vasoconstrictor impulses fromthe brain. Early studies had suggested that the hypotensiveaction of α-methyldopa was a result of the peripheral propertiesof the drug as a decarboxylase inhibitor or a falsetransmitter.
공급사20 곳
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