Hexahydroramipril

HCID 15068009CAS 99742-35-5
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCC[C@@H]21
InChIKey
REDFEBRIUVBHFO-JBDAPHQKSA-N
분자식
C23H38N2O5
평균 분자량
422.6 g/mol

이름 및 식별자

우선 이름
Hexahydroramipril
IUPAC
(2S,3aS,6aS)-1-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl]amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid
영어명
[2S-[1[R*(R*)],2α,3aβ,6aβ]]-1-[2-[[3-Cyclohexyl-1-(ethoxycarbonyl)propyl]aMino]-1-oxoprop
분자식
C23H38N2O5
분자량
422.56

이름 및 동의어

Hexahydroramipril99742-35-5Ramipril EP Impurity C(2S,3aS,6aS)-1-[(2S)-2-[[(2S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl]amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid8G04V75L6Q(2S,3aS,6aS)-1-((2S)-2-(((1S)-3-Cyclohexyl-1-(ethoxycarbonyl)-propyl)amino)propanoyl)octahydrocyclopenta(b)pyrrole-2-carboxylic acidCyclopenta(b)pyrrole-2-carboxylic acid, 1-((2S)-2-(((1S)-3-cyclohexyl-1-(ethoxycarbonyl)propyl)amino)-1-oxopropyl)octahydro-, (2S,3aS,6aS)-(2S,3AS,6aS)-1-((S)-2-(((S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl)amino)propanoyl)octahydrocyclopenta[b]pyrrole-2-carboxylic acidUNII-8G04V75L6QRamipril specified impurity C [EP]Ramipril impurity C CRSorb3217151
이름 더 보기
Ramipril EP Imp CRamipril Impurity 26RaMipril EP IMp C(USP RC C)Cyclohexyl RaMipril AnalogueRamipril EP Impurity C(USP RC C)Ramipril Impurity Ⅲ:Ramipril EP Impurity CRamipril Impurity Ⅲ:Ramipril EP Impurity CRamipril Impurity 3(Ramipril EP Impurity C)
SCHEMBL4609538RAMIPRIL IMPURITY C [EP IMPURITY]Q27270354(2S,3aS,6aS)-1-(((S)-4-cyclohexyl-1-ethoxy-1-oxobutan-2-yl)-L-alanyl)octahydrocyclopenta[b]pyrrole-2-carboxylic acid(2S,3aS,6aS)-1-[(2S)-2-[[(1S)-3-cyclohexyl-1-(ethoxycarbonyl)-propyl]amino]propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid (hexahydroramipril); Cyclopenta[b]pyrrole-2-carboxylic acid, 1-[2-[[3-cyclohexyl-1-(ethoxycarbonyl)propyl]amino]-1-oxopropyl]octahydro-, [2S-[1[R*(R*)],2alpha,3abeta,6abeta]]-; Ramipril Imp. C (EP)(2S,3aS,6aS)-1-[(S)-2-[[(S)-1-(Ethoxycarbonyl)-3-cyclohexylpropyl]amino]propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid

데이터베이스 식별자

CAS
99742-35-5
PubChem CID
15068009
UNII
8G04V75L6Q
Nikkaji
J1.380.342K

물성

구조 계산 물성

XLogP
2.6
극성 표면적
95.9 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
6
회전 가능 결합 수
10
무거운 원자 수
30

물리화학적 성질

끓는 점
591.1 · 591.1±45.0 °C(Predicted)
밀도
1.146 · 1.146±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
3.15 · 3.15±0.20(Predicted)
주요 응용
의약품(소분자)
InChIKey
REDFEBRIUVBHFO-JBDAPHQKSA-N

화학 및 산업

응용 분야

용도Cyclohexyl Ramipril analogue is an impurity of Ramipril (R111000). Ramipril Impurity C.

공급사36 곳

上海策嵘生物科技有限公司[email protected]
济南百隆化学有限公司[email protected] · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]

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