기본 정보
- 표준 SMILES
CC[C@@H](C)C[C@@H](CC(=O)OC(C)(C)C)C(=O)N1C(=O)O[C@@H](c2ccccc2)[C@H]1C- InChIKey
GSRYOMXTHAIEMA-ZTRFORPCSA-N- 분자식
- C23H33NO5
- 평균 분자량
- 403.5 g/mol
이름 및 식별자
- 우선 이름
- (3S,5R)-5-Methyl-3-[1-((4R,5S)-4-methyl-2-oxo-5-phenyl-oxazolidin-3-yl)-methanoyl]-heptanoic acid tert-butyl ester
- IUPAC
- tert-butyl (3S,5R)-5-methyl-3-[(4R,5S)-4-methyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carbonyl]heptanoate
이름 및 동의어
SCHEMBL1199190GSRYOMXTHAIEMA-ZTRFORPCSA-N(3S,5R)-5-Methyl-3-[1 -((4R,5S)-4-methyl-2-oxo-5-phenyl-oxazolidin-3-yl)-methanoyl]-heptanoic acid tert-butyl ester(3S,5R)-5-Methyl-3-[1-((4R,5S)-4-methyl-2-oxo-5-phenyl-oxazolidin-3-yl)-methanoyl]-heptanoic acid tert-butyl ester(3S,5R)-5-Methyl-3-[1-((4R5S)4-methyl-2-oxo-5-phenyl-oxazolidin-3-yl)-methanoyl]-heptanoic acid tert-butyl estertert-butyl (3S,5R)-5-methyl-3-{[(4R,5S)-4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl]carbonyl}heptanoate
데이터베이스 식별자
- PubChem CID
- 66939639
물성
구조 계산 물성
- XLogP
- 4.6
- 극성 표면적
- 72.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 591
관련 반응
11건
화합물 노트
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