[(2S,3R,4R,6S)-6-[(2R,3S,6S)-6-[[(1S,4aS,12aR)-3-乙酰基-4,4a,6,12a-四羟基-9-甲氧基-11-甲基-2,5,7,10-四氧代-1,12-二氢并四苯-1-基]氧基]-2-甲基四氢吡喃-3-基]氧基-4-羟基-2,4-二甲基四氢吡喃-3-基] (Z,4R)-2,4-二甲基庚-2-烯酸酯
[CAS# 146663-67-4]

基本信息

• 产品名称: [(2S,3R,4R,6S)-6-[(2R,3S,6S)-6-[[(1S,4aS,12aR)-3-乙酰基-4,4a,6,12a-四羟基-9-甲氧基-11-甲基-2,5,7,10-四氧代-1,12-二氢并四苯-1-基]氧基]-2-甲基四氢吡喃-3-基]氧基-4-羟基-2,4-二甲基四氢吡喃-3-基] (Z,4R)-2,4-二甲基庚-2-烯酸酯
• 英文名: [(2S,3R,4R,6S)-6-[(2R,3S,6S)-6-[[(1S,4aS,12aR)-3-Acetyl-4,4a,6,12a-Tetrahydroxy-9-Methoxy-11-Methyl-2,5,7,10-Tetraoxo-1,12-Dihydrotetracen-1-Yl]Oxy]-2-Methyloxan-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyloxan-3-Yl] (Z,4R)-2,4-Dimethylhept-2-Enoate
• 别名: [(2S,3R,4R,6S)-6-[(2R,3S,6S)-6-[[(1S,4As,12Ar)-3-Acetyl-4,4A,6,12A-Tetrahydroxy-9-Methoxy-11-Methyl-2,5,7,10-Tetraoxo-1,12-Dihydrotetracen-1-Yl]Oxy]-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] (Z,4R)-2,4-Dimethylhept-2-Enoate; (Z,4R)-2,4-Dimethylhept-2-Enoic Acid [(2S,3R,4R,6S)-6-[[(2R,3S,6S)-6-[[(1S,4As,12Ar)-3-Acetyl-4,4A,6,12A-Tetrahydroxy-9-Methoxy-11-Methyl-2,5,7,10-Tetraoxo-1,12-Dihydrotetracen-1-Yl]Oxy]-2-Methyl-3-Tetrahydropyranyl]Oxy]-4-Hydroxy-2,4-Dimethyl-3-Tetrahydropyranyl] Ester; (Z,4R)-2,4-Dimethylhept-2-Enoic Acid [(2S,3R,4R,6S)-6-[(2R,3S,6S)-6-[[(1S,4As,12Ar)-3-Acetyl-4,4A,6,12A-Tetrahydroxy-2,5,7,10-Tetraketo-9-Methoxy-11-Methyl-1,12-Dihydrotetracen-1-Yl]Oxy]-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] Ester
• 分子式: C₄₄H₅₄O₁₇
• 分子量: 854.90
• CAS 登录号: 146663-67-4
• 分子行输入简码 SMILES: [C@]24(O)[C@](O)(C(=O)C1=C(O)C3=C(C(=C1C2)C)C(=O)C(=CC3=O)OC)C(=C(C(=O)[C@H]4O[C@@H]6O[C@@H]([C@@H](O[C@@H]5O[C@H]([C@@H](OC(=O)C(=C\[C@@H](CCC)C)/C)[C@](O)(C5)C)C)CC6)C)C(=O)C)O
• 国际化学标识码 InChI: 1S/C44H54O17/c1-10-11-18(2)14-19(3)41(52)61-39-23(7)58-29(17-42(39,8)53)59-26-12-13-28(57-22(26)6)60-40-36(49)31(21(5)45)37(50)44(55)38(51)32-24(16-43(40,44)54)20(4)30-33(35(32)48)25(46)15-27(56-9)34(30)47/h14-15,18,22-23,26,28-29,39-40,48,50,53-55H,10-13,16-17H2,1-9H3/b19-14-/t18-,22-,23+,26+,28+,29+,39-,40-,42-,43-,44-/m1/s1
• 国际化学标识检索码 InChIKey: ZYPYHMZLLIDAAL-WNMWLNICSA-N

物理化学性质

• 密度: 1.433g/cm³ （计算值）
• 沸点: 1022.105°C at 760 mmHg （计算值）
• 闪点: 302.468°C （计算值）