기본 정보
- 표준 SMILES
C[C@H](CC#CC(C)(C)O[Si](C)(C)C)C1=CCC[C@H]2/C(=C/C=C3C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H](O[Si](C)(C)C(C)(C)C)C3)CCC[C@]12C- InChIKey
FZAGLFUSYIAGKR-PHNPIFMQSA-N- 분자식
- C42H76O3Si3
- 평균 분자량
- 713.3 g/mol
이름 및 식별자
- 우선 이름
- (4aS,8aS)-4-{(E)-2-[(3R,5R)-3,5-Bis-(tert-butyl-dimethyl-silanyloxy)-cyclohexylidene]-ethylidene}-8-((R)-1,5-dimethyl-5-trimethylsilanyloxy-hex-3-ynyl)-8a-methyl-1,2,3,4,4a,5,6,8a-octahydro-naphthalene
- IUPAC
- [(1R,5R)-3-[(2E)-2-[(4aS,8aS)-4a-methyl-5-[(2R)-6-methyl-6-trimethylsilyloxyhept-4-yn-2-yl]-2,3,4,7,8,8a-hexahydronaphthalen-1-ylidene]ethylidene]-5-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-tert-butyl-dimethylsilane
이름 및 동의어
SCHEMBL8524477FZAGLFUSYIAGKR-PHNPIFMQSA-N(4aS,8aS)-4-{(E)-2-[(3R,5R)-3,5-Bis-(tert-butyl-dimethyl-silanyloxy)-cyclohexylidene]-ethylidene}-8-((R)-1,5-dimethyl-5-trimethylsilanyloxy-hex-3-ynyl)-8a-methyl-1,2,3,4,4a,5,6,8a-octahydro-naphthalene
데이터베이스 식별자
- PubChem CID
- 86754180
물성
구조 계산 물성
- 극성 표면적
- 27.7 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 48
- 형식 전하
- 0
- 복잡도
- 1,250
관련 반응
1건
화합물 노트
불러오는 중…