6-O-烟酰半枝莲素C结构式
|
常用名 | 6-O-烟酰半枝莲素C | 英文名 | 6-o-nicotinoylbarbatin c |
|---|---|---|---|---|
| CAS号 | 1015776-92-7 | 分子量 | 453.527 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 595.2±50.0 °C at 760 mmHg | |
| 分子式 | C26H31NO6 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 313.8±30.1 °C |
| 中文名 | 6-O-烟酰半枝莲素 C |
|---|---|
| 英文名 | (1R,2S,3R,4R,4aS,8aR)-2,3-Dihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2 -(5-oxo-2,5-dihydro-3-furanyl)vinyl]-1,2,3,4,4a,5,6,8a-octahydro- 1-naphthalenyl nicotinate |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 595.2±50.0 °C at 760 mmHg |
| 分子式 | C26H31NO6 |
| 分子量 | 453.527 |
| 闪点 | 313.8±30.1 °C |
| 精确质量 | 453.215149 |
| PSA | 105.95000 |
| LogP | 2.72 |
| InChIKey | BWDKUBKSGGMGOD-GLTZHHDWSA-N |
| SMILES | CC1=CCCC2C1(C)C(OC(=O)c1cccnc1)C(O)C(C)(O)C2(C)C=CC1=CC(=O)OC1 |
| 蒸汽压 | 0.0±1.8 mmHg at 25°C |
| 折射率 | 1.607 |
| (1R,2S,3R,4R,4aS,8aR)-2,3-Dihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2-(5-oxo-2,5-dihydro-3-furanyl)vinyl]-1,2,3,4,4a,5,6,8a-octahydro-1-naphthalenyl nicotinate |
| 3-Pyridinecarboxylic acid, (1R,2S,3R,4R,4aS,8aR)-4-[(E)-2-(2,5-dihydro-5-oxo-3-furanyl)ethenyl]-1,2,3,4,4a,5,6,8a-octahydro-2,3-dihydroxy-3,4,8,8a-tetramethyl-1-naphthalenyl ester |