(3S,5R,10R,13R,14S,17R)-3-[(2S,5R)-3,5-二羟基-4-甲氧基-6-甲基四氢吡喃-2-基]氧基-14-羟基-13-甲基-17-(5-氧代-2H-呋喃-3-基)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-十四氢环戊烯并[a]菲-10-甲醛
[CAS# 1182-87-2]

基本信息

• 产品名称: (3S,5R,10R,13R,14S,17R)-3-[(2S,5R)-3,5-二羟基-4-甲氧基-6-甲基四氢吡喃-2-基]氧基-14-羟基-13-甲基-17-(5-氧代-2H-呋喃-3-基)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-十四氢环戊烯并[a]菲-10-甲醛
• 英文名: (3S,5R,10R,13R,14S,17R)-3-[(2S,5R)-3,5-Dihydroxy-4-Methoxy-6-Methyloxan-2-Yl]Oxy-14-Hydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[a]Phenanthrene-10-Carbaldehyde
• 别名: (3S,5R,10R,13R,14S,17R)-3-[(2S,5R)-3,5-Dihydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-14-Hydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-10-Carbaldehyde; (3S,5R,10R,13R,14S,17R)-3-[[(2S,5R)-3,5-Dihydroxy-4-Methoxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-14-Hydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-10-Carboxaldehyde; (3S,5R,10R,13R,14S,17R)-3-[(2S,5R)-3,5-Dihydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-14-Hydroxy-17-(5-Keto-2H-Furan-3-Yl)-13-Methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthrene-10-Carbaldehyde
• 分子式: C₃₀H₄₄O₉
• 分子量: 548.67
• CAS 登录号: 1182-87-2
• EINECS 登录号: 214-659-9
• 分子行输入简码 SMILES: [C@]45([C@@](O)(C1C([C@@]3([C@H](CC1)C[C@@H](O[C@H]2OC([C@@H](O)C(OC)C2O)C)CC3)C=O)CC4)CC[C@@H]5C6=CC(OC6)=O)C
• 国际化学标识码 InChI: 1S/C30H44O9/c1-16-24(33)26(36-3)25(34)27(38-16)39-19-6-10-29(15-31)18(13-19)4-5-22-21(29)7-9-28(2)20(8-11-30(22,28)35)17-12-23(32)37-14-17/h12,15-16,18-22,24-27,33-35H,4-11,13-14H2,1-3H3/t16?,18-,19+,20-,21?,22?,24-,25?,26?,27-,28-,29-,30+/m1/s1
• 国际化学标识检索码 InChIKey: PMTSPAGBAFCORP-DGORKHCUSA-N

物理化学性质

• 密度: 1.317g/cm³ （计算值）
• 沸点: 731.575°C at 760 mmHg （计算值）
• 闪点: 236.21°C （计算值）