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기본 정보
- CAS
161389-25-9- 표준 SMILES
COc1ccc(CN[C@@H](C(=O)N[C@H](C(=O)NCc2nc3ccccc3[nH]2)C(C)C)[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@](C)(O)c2ccccc2)C(C)(C)C)cc1- InChIKey
GSXZOVDJUCOJAW-JZPLEXDRSA-N- 분자식
- C47H59N7O7
- 평균 분자량
- 834.031 g/mol
- 단동위원소 질량
- 833.44759723
이름 및 식별자
- 우선 이름
- (2R,3S,4S)-N-(2-(4-Methoxybenzylamine)-4-((N-((((S)-phenyllactoyl))tert-leucine)amino)-3-hydroxy-5-phenylpentanoyl)valine (2-benzimidazolyl)methylamide
- IUPAC
- (2R,3R,4S)-N-[(2S)-1-{[(1H-Benzimidazol-2-yl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-3-hydroxy-4-{[(2S)-2-{[(2S)-2-hydroxy-2-phenylpropanoyl]amino}-3,3-dimethylbutanoyl]amino}-2-{[(4-methoxyphenyl)methyl]amino}-5-phenylpentanamide
- 영어명
- (2R,3S,4S)-N-[2-(4-Methoxybenzylamine)-4-[[N-[[((S)-phenyllactoyl))ter t-leucine]amino]-3-hydroxy- 5-phenylpentanoyl]valine (2-benzimidazolyl )methylamide
- 분자식
- C47H59N7O7
- 분자량
- 834.02
이름 및 동의어
(2R,3S,4S)-N-[2-(4-Methoxybenzylamine)-4-[[N-[[((S)-phenyllactoyl))ter t-leucine]amino]-3-hydroxy- 5-phenylpentanoyl]valine (2-benzimidazolyl )methylamideL-Lyxonamide, N-[1-[[(1H-benzimidazol-2-ylmethyl)amino]carbonyl]-2-methylpropyl]-2,4,5-trideoxy-4-[[2-[(2-hydroxy-1-oxo-2-phenylpropyl)amino]-3,3-dimethyl-1-oxobutyl]amino]-2-[[(4-methoxyphenyl)methyl]amino]-5-phenyl-, [1(S),4[S(S)]]- (9CI)
데이터베이스 식별자
- CAS
161389-25-9- PubChem CID
- 460243
- DTXSID
DTXSID50167137
물성
물리화학적 성질
- 끓는 점
- 1151.557 · 1151.557±65.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.229 · 1.229±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 11.473 · 11.473±0.10(predicted)
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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