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기본 정보
- CAS
91269-93-1- 표준 SMILES
CC(C)C[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCCN1C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)O- InChIKey
CMROHJJOEVQGCF-QBYFNBPSSA-N- 분자식
- C45H67N7O8
- 평균 분자량
- 834.072 g/mol
- 단동위원소 질량
- 833.5051121
이름 및 식별자
- 우선 이름
- N-[2-({2-[(2-{[{1-[N-(2-Amino-1-hydroxy-3-methylbutylidene)leucyl]pyrrolidin-2-yl}(hydroxy)methylidene]amino}-1-hydroxy-3-phenylpropylidene)amino]-1-hydroxy-3-phenylpropylidene}amino)-1-hydroxy-3-methylbutylidene]leucine
- IUPAC
- N-[(2S)-2-{[(2S)-2-{[(2S)-2-{[(1-{N-[(2S)-2-Amino-1-hydroxy-3-methylbutylidene]-D-leucyl}pyrrolidin-2-yl)(hydroxy)methylidene]amino}-1-hydroxy-3-phenylpropylidene]amino}-1-hydroxy-3-phenylpropylidene]amino}-1-hydroxy-3-methylbutylidene]-D-leucine
- 현지명
- 발릴-류실-프롤릴-페닐알라닐-페닐알라닐-발릴-류신
- 영어명
- valyl-leucyl-prolyl-phenylalanyl-phenylalanyl-valyl-leucine
- 분자식
- C45H67N7O8
- 분자량
- 834.06
이름 및 동의어
발릴-류실-프롤릴-페닐알라닐-페닐알라닐-발릴-류신valyl-leucyl-prolyl-phenylalanyl-phenylalanyl-valyl-leucine(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[1-[(2R)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoic acid
데이터베이스 식별자
- CAS
91269-93-1- PubChem CID
- 124622
- DTXSID
DTXSID80919863
물성
물리화학적 성질
- 끓는 점
- 1126.724 · 1126.724±65.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.173 · 1.173±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 3.391 · 3.391±0.10(predicted)
관련 반응
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