기본 정보
- CAS
191529-67-6- 표준 SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C- InChIKey
MKIGAEZXUXVXSS-UEMCXGCWSA-N- 분자식
- C81H119N19O30S2
- 평균 분자량
- 1,903.1 g/mol
- 단동위원소 질량
- 1,901.7811658
이름 및 식별자
- 우선 이름
- H-Glu-Ala-Gly-Asp-Asp-Ile-Val-Pro-Cys-Ser-Met-Ser-Tyr-Thr-Trp-Thr-Gly-Ala-OH
- IUPAC
- (4S)-4-amino-5-[[(2S)-1-[[2-[[(2S)-3-carboxy-1-[[(2S)-3-carboxy-1-[[(2S,3S)-1-[[(2S)-1-[(2S)-2-[[(2R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-[[(2S,3R)-1-[[2-[[(1S)-1-carboxyethyl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
- 영어명
- S5A/5B
- 분자식
- C81H119N19O30S2
- 분자량
- 1903.05
이름 및 동의어
191529-67-6H-Glu-Ala-Gly-Asp-Asp-Ile-Val-Pro-Cys-Ser-Met-Ser-Tyr-Thr-Trp-Thr-Gly-Ala-OHHepatitis C Virus S5A/5Borb1980919DA-53974FG110926T76524S5A/5BGLU-ALA-GLY-ASP-ASP-ILE-VAL-PRO-CYS-SER-MET-SER-TYR-THR-TRP-THR-GLY-ALAL-α-Glutamyl-L-alanylglycyl-L-α-aspartyl-L-α-aspartyl-L-isoleucyl-L-valyl-L-prolyl-L-cysteinyl-L-seryl-L-methionyl-L-seryl-L-tyrosyl-L-threonyl-L-tryptophyl-L-threonylglycyl-L-alanineL-Alanine, L-α-glutamyl-L-alanylglycyl-L-α-aspartyl-L-α-aspartyl-L-isoleucyl-L-valyl-L-prolyl-L-cysteinyl-L-seryl-L-methionyl-L-seryl-L-tyrosyl-L-threonyl-L-tryptophyl-L-threonylglycyl-
데이터베이스 식별자
- CAS
191529-67-6- PubChem CID
- 131698190
물성
구조 계산 물성
- XLogP
- -7.6
- 극성 표면적
- 804 Ų
- 수소 결합 공여자 수
- 28
- 수소 결합 수용자 수
- 33
- 회전 가능 결합 수
- 56
- 무거운 원자 수
- 132
- 형식 전하
- 0
- 복잡도
- 4,040
물리화학적 성질
- 끓는 점
- 2224.5 · 2224.5±65.0 °C(Predicted)
- 밀도
- 1.405 · 1.405±0.06 g/cm3(Predicted)
- 저장 조건
- -15 °C · -15°C
- 산도 계수 (pKa)
- 3.42 · 3.42±0.10(Predicted)
화학 및 산업
공급사26 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
南京昱盛康生物科技有限公司13327808530 · [email protected]
上海鸿肽生物科技有限公司15318089928 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
Chengdu Youngshe Chemical Co., Ltd.+86-18108235634 · [email protected]
太原百利恒康生物技术有限公司19135651983 · [email protected]
LEON (NANJING) BIOTECHNOLOGY CO., LTD.15051830413 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
南京肽谷生物科技有限公司18115476705 · [email protected]
南京莱昂生物科技有限公司025-84523390 -127; 17705183659 · [email protected]
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