6-alpha,9-alpha-二氟-11-beta,16-alpha,17-alpha,21-四羟基孕甾-1,4-二烯-3,20-二酮
[CAS# 807-38-5]

基本信息

• 产品名称: 6-alpha,9-alpha-二氟-11-beta,16-alpha,17-alpha,21-四羟基孕甾-1,4-二烯-3,20-二酮
• 英文名: 6-alpha,9-alpha-Difluoro-11-beta,16-alpha,17-alpha,21-Tetrahydroxypregna-1,4-Diene-3,20-Dione
• 别名: (6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-Difluoro-11,16,17-Trihydroxy-17-(2-Hydroxy-1-Oxoethyl)-10,13-Dimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-3-One; (6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-Difluoro-17-Glycoloyl-11,16,17-Trihydroxy-10,13-Dimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-3-One; (6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-Difluoro-11,16,17-Trihydroxy-17-(2-Hydroxyethanoyl)-10,13-Dimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-3-One
• 分子式: C₂₁H₂₆F₂O₆
• 分子量: 412.43
• CAS 登录号: 807-38-5
• EINECS 登录号: 212-362-9
• 分子行输入简码 SMILES: [C@H]2(C1=CC(=O)C=C[C@@]1([C@@]4([C@@H](C2)[C@@H]3C[C@@H](O)[C@]([C@@]3(C)C[C@@H]4O)(O)C(=O)CO)F)C)F
• 国际化学标识码 InChI: 1S/C21H26F2O6/c1-18-4-3-10(25)5-13(18)14(22)6-12-11-7-15(26)21(29,17(28)9-24)19(11,2)8-16(27)20(12,18)23/h3-5,11-12,14-16,24,26-27,29H,6-9H2,1-2H3/t11-,12-,14-,15+,16-,18-,19-,20-,21-/m0/s1
• 国际化学标识检索码 InChIKey: UUOUOERPONYGOS-CLCRDYEYSA-N

物理化学性质

• 密度: 1.458g/cm³ （计算值）
• 沸点: 588.984°C at 760 mmHg （计算值）
• 闪点: 310.006°C （计算值）