Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Trigonosin F
Trigonosin F · 4,24-Methano-2,20,23-(epoxymetheno)-7,10-methanocyclopenta[b]-1,3-dioxino[4,5-h]oxireno[e]oxacycloheneicosin-16(4H)-one, 11-(benzoyloxy)-4a,5,6,7,8,9,10,11,17a,18,19,20,20a,21,21a,22a,23,23a-octadecahydro-4a,5,20a,21-tetrahydroxy-21a-(hydroxymethyl)-5,18,26,27-tetramethyl-2-phenyl-, (2R,4R,4aR,5S,7S... · 4,24-Methano-2,20,23-(epoxymetheno)-7,10-methanocyclopenta[b]-1,3-dioxino[4,5-h]oxireno[e]oxacycloheneicosin-16(4H)-one, 11-(benzoyloxy)-4a,5,6,7,8,9,10,11,17a,18,19,20,20a,21,21a,22a,23,23a-octadecahydro-4a,5,20a,21-tetrahydroxy-21a-(hydroxymethyl)-5,18,26,27-tetramethyl-2-phenyl-, (2R,4R,4aR,5S,7S,10R,11R,12E,14Z,17aR,18R,20S,20aR,21R,21aS,22aR,23R,23aS,24S,26R,27R)-rel-(+)-
식별자 및 물리적 특성
| CAS No. | 1262842-73-8 |
|---|---|
| 분자식 | C46H54O13 |
| 평균 분자량 | 814.91 g/mol |
| SMILES | C[C@H]1[C@@H]2CC[C@@H]1[C@@H](OC(=O)c1ccccc1)/C=C/C=C\C(=O)O[C@H]1[C@@H](C)C[C@@H]3[C@]1(O)[C@H](O)[C@@]1(CO)OC1[C@H]1[C@H]4O[C@]5(c6ccccc6)O[C@@H]([C@@H](C)[C@]31O5)C4(O)[C@](C)(O)C2 |
| InChIKey | ZDIWBBJUVBDSOV-YPFJMDPJSA-N |
화학 및 물리적 성질
| 밀도 | 1.45±0.1 g/cm3(Predicted) |
|---|---|
| pKa(산도 계수) | 12.10±0.70(Predicted) |