(4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-[(E)-3-(4-羟基苯基)丙-2-烯酰基]氧基-6a-[[(E)-3-(4-羟基苯基)丙-2-烯酰基]氧基甲基]-2,2,6B,9,9,12a-六甲基-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-十四氢苉-4a-羧酸
[CAS# 152509-92-7]

基本信息

• 产品名称: (4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-[(E)-3-(4-羟基苯基)丙-2-烯酰基]氧基-6a-[[(E)-3-(4-羟基苯基)丙-2-烯酰基]氧基甲基]-2,2,6B,9,9,12a-六甲基-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-十四氢苉-4a-羧酸
• 英文名: (4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-[(E)-3-(4-Hydroxyphenyl)Prop-2-Enoyl]Oxy-6a-[[(E)-3-(4-Hydroxyphenyl)Prop-2-Enoyl]Oxymethyl]-2,2,6B,9,9,12a-Hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-Tetradecahydropicene-4a-Carboxylic Acid
• 别名: (4As,6Ar,6Ar,6Br,8Ar,10S,12Ar,14Bs)-10-[(E)-3-(4-Hydroxyphenyl)-1-Oxoprop-2-Enoxy]-6A-[[(E)-3-(4-Hydroxyphenyl)-1-Oxoprop-2-Enoxy]Methyl]-2,2,6B,9,9,12A-Hexamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid; (4As,6Ar,6Ar,6Br,8Ar,10S,12Ar,14Bs)-10-[(E)-3-(4-Hydroxyphenyl)Acryloyl]Oxy-6A-[[(E)-3-(4-Hydroxyphenyl)Acryloyl]Oxymethyl]-2,2,6B,9,9,12A-Hexamethyl-1,3,4,5,6,6A,7,8,8A,10,11,12,13,14B-Tetradecahydropicene-4A-Carboxylic Acid; 3,27-Di-O-P-Coumaroyloxyolean-12-En-28-Oic Acid
• 分子式: C₄₈H₆₀O₈
• 分子量: 765.00
• CAS 登录号: 152509-92-7
• 分子行输入简码 SMILES: [C@@]34([C@@H]([C@@]2([C@H](C([C@@H](OC(=O)\C=C\C1=CC=C(O)C=C1)CC2)(C)C)CC3)C)CC=C5[C@]4(CC[C@@]6([C@H]5CC(CC6)(C)C)C(=O)O)COC(=O)\C=C\C7=CC=C(O)C=C7)C
• 国际化学标识码 InChI: 1S/C48H60O8/c1-43(2)25-26-47(42(53)54)27-28-48(30-55-40(51)19-11-31-7-13-33(49)14-8-31)35(36(47)29-43)17-18-38-45(5)23-22-39(44(3,4)37(45)21-24-46(38,48)6)56-41(52)20-12-32-9-15-34(50)16-10-32/h7-17,19-20,36-39,49-50H,18,21-30H2,1-6H3,(H,53,54)/b19-11+,20-12+/t36-,37-,38+,39-,45-,46+,47-,48-/m0/s1
• 国际化学标识检索码 InChIKey: YBOIBOWMTWFCEG-MVYRAAOISA-N

物理化学性质

• 密度: 1.243g/cm³ （计算值）
• 沸点: 837.777°C at 760 mmHg （计算值）
• 闪点: 241.783°C （计算值）