N(엡실론)-아세트이미도글루카곤
N(epsilon)-acetimidoglucagon
기본 정보
- CAS
74619-75-3- 표준 SMILES
CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCNC(C)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O- InChIKey
VYBYTAXIGUPQBB-JPFJGECISA-N- 분자식
- C155H228N44O49S
- 평균 분자량
- 3,523.8 g/mol
- 단동위원소 질량
- 3,521.642251
이름 및 식별자
- 우선 이름
- N(epsilon)-acetimidoglucagon
- IUPAC
- (3S)-3-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3R)-2-[[2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-6-(ethanimidoylamino)hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-3-carboxypropanoyl]amino]-3-hydroxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-amino-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-1,4-dioxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
- 현지명
- N(엡실론)-아세트이미도글루카곤
- 영어명
- N(epsilon)-acetimidoglucagon
- 분자식
- C155H228N44O49S
- 분자량
- 3523.79922
이름 및 동의어
N-epsilon-AcetimidoglucagonN(epsilon)-Acetimidoglucagon74619-75-3RefChem:160856N(epsilon)-AcetamidoglucagonN(epsilon)-Lysine acetimidoglucagonGlucagon (pig), 12-(N6-(1-iminoethyl)-L-lysine)-N(엡실론)-아세트이미도글루카곤
데이터베이스 식별자
- CAS
74619-75-3- PubChem CID
- 126843376
물성
구조 계산 물성
- XLogP
- -14.3
- 극성 표면적
- 1,570 Ų
- 수소 결합 공여자 수
- 56
- 수소 결합 수용자 수
- 55
- 회전 가능 결합 수
- 117
- 무거운 원자 수
- 249
- 형식 전하
- 0
- 복잡도
- 8,310
관련 반응
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