齐墩果酸 3-O-alpha-L-吡喃鼠李糖基(1-3)-beta-D-吡喃木糖基(1-3)-alpha-L-吡喃鼠李糖基(1-2)-alpha-L-阿拉伯糖吡喃糖苷
[CAS# 141544-42-5]

基本信息

• 产品名称: 齐墩果酸 3-O-alpha-L-吡喃鼠李糖基(1-3)-beta-D-吡喃木糖基(1-3)-alpha-L-吡喃鼠李糖基(1-2)-alpha-L-阿拉伯糖吡喃糖苷
• 英文名: Oleanolic acid 3-O-alpha-L-rhamnopyranosyl(1-3)-beta-D-xylopyranosyl(1-3)-alpha-L-rhamnopyranosyl(1-2)-alpha-L-arabinopyranoside
• 别名: (4As,6Ar,6As,6Br,10S,12Ar,14Br)-10-[(2S,3R,4S,5S)-3,5-Bis[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy]-4-[(2R,3R,4S,5R)-3,4,5-Trihydroxytetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-2,2,6A,6B,9,9,12A-Heptamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid; (4As,6Ar,6As,6Br,10S,12Ar,14Br)-10-[[(2S,3R,4S,5S)-3,5-Bis[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-[[(2R,3R,4S,5R)-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-2,2,6A,6B,9,9,12A-Heptamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid; (4As,6Ar,6As,6Br,10S,12Ar,14Br)-10-[(2S,3R,4S,5S)-3,5-Bis[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl]Oxy]-4-[(2R,3R,4S,5R)-3,4,5-Trihydroxyoxan-2-Yl]Oxy-Oxan-2-Yl]Oxy-2,2,6A,6B,9,9,12A-Heptamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid
• 分子式: C₅₂H₈₄O₁₉
• 分子量: 1013.22
• CAS 登录号: 141544-42-5
• 分子行输入简码 SMILES: [C@@]67([C@@H]([C@@]5(C(C([C@@H](O[C@@H]3OC[C@H](O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)[C@H](O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]3O[C@@H]4O[C@H]([C@H](O)[C@@H](O)[C@H]4O)C)CC5)(C)C)CC6)C)CC=C8[C@]7(CC[C@@]9([C@@H]8CC(CC9)(C)C)C(=O)O)C)C
• 国际化学标识码 InChI: 1S/C52H84O19/c1-23-32(54)35(57)38(60)43(66-23)68-28-22-65-45(41(71-44-39(61)36(58)33(55)24(2)67-44)40(28)70-42-37(59)34(56)27(53)21-64-42)69-31-13-14-49(7)29(48(31,5)6)12-15-51(9)30(49)11-10-25-26-20-47(3,4)16-18-52(26,46(62)63)19-17-50(25,51)8/h10,23-24,26-45,53-61H,11-22H2,1-9H3,(H,62,63)/t23-,24-,26+,27+,28-,29?,30+,31-,32-,33-,34-,35+,36+,37+,38+,39+,40-,41+,42+,43-,44-,45-,49-,50+,51+,52-/m0/s1
• 国际化学标识检索码 InChIKey: XAFDYNYZRDQZAF-KVACYZFBSA-N

物理化学性质

• 密度: 1.394g/cm³ （计算值）