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기본 정보
- CAS
162539-57-3- 표준 SMILES
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC[C@@H](O)[C@H](Cc1ccc(OCCc2ccccn2)cc1)NC(=O)OC(C)(C)C- InChIKey
XGSPSWMOULVMMN-UYEZAFAQSA-N- 분자식
- C37H52N4O7
- 평균 분자량
- 664.844 g/mol
- 단동위원소 질량
- 664.3836
이름 및 식별자
- 우선 이름
- 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-((4-(2-(2-pyridinyl)ethoxy)phenyl)methyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-
- IUPAC
- tert-Butyl [(2S,3R)-4-({(2R,3S)-3-[(tert-butoxycarbonyl)amino]-2-hydroxy-4-phenylbutyl}amino)-3-hydroxy-1-{4-[2-(pyridin-2-yl)ethoxy]phenyl}butan-2-yl]carbamate
- 영어명
- [1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]- 2-hydroxy-4-[4-[2-(2-pyridinyl)ethoxy]phenyl]butyl]amino]-2-hydroxy-1- (phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester
- 분자식
- C37H52N4O7
- 분자량
- 664.83
이름 및 동의어
Aids033293Aids-03329312-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-[[4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-, 1,1-dimethylethyl ester, (3S,4R,8R,9S)-12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-11-oxo-3-(phenylmethyl)-9-[[4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-, 1,1-dimethylethyl ester, [3S-(3R*,4S*,8S*,9R*)]-[1S-[1R*,2S*(2S*,3R*)]]-[3-[[3-[[(1,1-Dimethylethoxy)-carbonyl]amino]- 2-hydroxy-4-[4-[2-(2-pyridinyl)ethoxy]phenyl]butyl]amino]-2-hydroxy-1- (phenylmethyl)propyl]carbamic Acid, 1,1-Dimethylethyl ester
데이터베이스 식별자
- CAS
162539-57-3- PubChem CID
- 463278
- DTXSID
DTXSID70167391- ChEMBL
CHEMBL59706
물성
물리화학적 성질
- 끓는 점
- 818.6 · 818.6±65.0 °C(Predicted)
- 밀도
- 1.163 · 1.163±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 11.9 · 11.90±0.46(Predicted)
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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