기본 정보
- 표준 SMILES
C=CCOC1CC(C=C(C)C2OC(=O)C3CCCCN3C(=O)C(=O)C3(O)OC(C(OC)CC(C)CC(C)=CC(CC)C(=O)CC(O[Si](C)(C)C(C)(C)C)C2C)C(OC)CC3C)CCC1OS(=O)(=O)c1ccccc1[N+](=O)[O-]- InChIKey
YTRDKMVUTRWTRF-UHFFFAOYSA-N- 분자식
- C57H88N2O16SSi
- 평균 분자량
- 1,117.5 g/mol
이름 및 식별자
- 우선 이름
- 17-Ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-(o-nitrobenzenesulfonyloxy)-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetraone
- IUPAC
- [4-[2-[14-[tert-butyl(dimethyl)silyl]oxy-17-ethyl-1-hydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-2,3,10,16-tetraoxo-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-en-12-yl]prop-1-enyl]-2-prop-2-enoxycyclohexyl] 2-nitrobenzenesulfonate
이름 및 동의어
YTRDKMVUTRWTRF-UHFFFAOYSA-N17-Ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-(o-nitrobenzenesulfonyloxy)-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9 ]octacos-18-ene-2,3,10,16-tetraone17-ethyl-1-hydroxy-14-(tert-butyldimethylsiloxy)-12-[2'-(4"-(o-nitrophenylsulfonyloxy)-3"-allyloxycyclohexyl)-1'-methylvinyl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9 ]octacos-18-ene-2,3,10,16-tetraone
데이터베이스 식별자
- PubChem CID
- 57086271
물성
구조 계산 물성
- 극성 표면적
- 245 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 77
- 형식 전하
- 0
- 복잡도
- 2,240
관련 반응
3건
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