6-((哌啶)乙酰氧基)-7-去乙酰基毛喉素盐酸盐
[CAS# 114376-11-3]

基本信息

• 产品名称: 6-((哌啶)乙酰氧基)-7-去乙酰基毛喉素盐酸盐
• 英文名: 6-((Piperidino)Acetoxy)-7-Desacetylforskolin hydrochloride
• 别名: [(3R,4Ar,5S,6S,6As,10S,10Ar,10Bs)-5,10,10B-Trihydroxy-3,4A,7,7,10A-Pentamethyl-1-Oxo-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-6-Yl] 2-(1-Piperidyl)Acetate Hydrochloride; 2-(1-Piperidyl)Acetic Acid [(3R,4Ar,5S,6S,6As,10S,10Ar,10Bs)-5,10,10B-Trihydroxy-3,4A,7,7,10A-Pentamethyl-1-Oxo-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-6-Yl] Ester Hydrochloride; 2-Piperidinoacetic Acid [(3R,4Ar,5S,6S,6As,10S,10Ar,10Bs)-5,10,10B-Trihydroxy-1-Keto-3,4A,7,7,10A-Pentamethyl-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-6-Yl] Ester Hydrochloride
• 分子式: C₂₇H₄₄ClNO₇
• 分子量: 530.10
• CAS 登录号: 114376-11-3
• 分子行输入简码 SMILES: [C@]13([C@H](C(CC[C@@H]1O)(C)C)[C@H](OC(=O)CN2CCCCC2)[C@H](O)[C@]4(O[C@@](CC(=O)[C@]34O)(C)C=C)C)C.[H+].[Cl-]
• 国际化学标识码 InChI: 1S/C27H43NO7.ClH/c1-7-24(4)15-18(30)27(33)25(5)17(29)11-12-23(2,3)21(25)20(22(32)26(27,6)35-24)34-19(31)16-28-13-9-8-10-14-28;/h7,17,20-22,29,32-33H,1,8-16H2,2-6H3;1H/t17-,20-,21-,22-,24-,25-,26+,27-;/m0./s1
• 国际化学标识检索码 InChIKey: QGRXRBJNZDDDHY-YHEOSNBFSA-N

物理化学性质

• 沸点: 607.6°C at 760 mmHg （计算值）
• 闪点: 321.3°C （计算值）