(3Z,5Z,7Z,11Z,13Z)-21-{2,4-二羟基-6-[2-({4-羟基-5-[(5-羟基-4-甲氧基-6-甲基四氢-2H-吡喃-2-基)氧基]-4,6-二甲基四氢-2H-吡喃-2-基}氧基)-3-甲氧基丙基]-3,5-二甲基四氢-2H-吡喃-2-基}-10-[(3,4-二羟基-5-甲氧基-6-甲基四氢-2H-吡喃-2-基)氧基]-17,20-二羟基-18-甲氧基-3,5,7,9,13-五甲基氧杂环二十一-3,5,7,11,13-五烯-2-酮
[CAS# 476647-30-0]

基本信息

• 产品名称: (3Z,5Z,7Z,11Z,13Z)-21-{2,4-二羟基-6-[2-({4-羟基-5-[(5-羟基-4-甲氧基-6-甲基四氢-2H-吡喃-2-基)氧基]-4,6-二甲基四氢-2H-吡喃-2-基}氧基)-3-甲氧基丙基]-3,5-二甲基四氢-2H-吡喃-2-基}-10-[(3,4-二羟基-5-甲氧基-6-甲基四氢-2H-吡喃-2-基)氧基]-17,20-二羟基-18-甲氧基-3,5,7,9,13-五甲基氧杂环二十一-3,5,7,11,13-五烯-2-酮
• 英文名: (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-Hydroxy-5-[(5-Hydroxy-4-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-4,6-Dimethyltetrahydro-2H-Pyran-2-Yl}Oxy)-3-Methoxypropyl]-3,5-Dimethyltetrahydro-2H -Pyran-2-Yl}-10-[(3,4-Dihydroxy-5-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-17,20-Dihydroxy-18-Methoxy-3,5,7,9,13-Pentamethyloxacyclohenicosa-3,5,7,11,13-Pentaen-2-One
• 别名: (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-4,6-dimethyltetrahydro-2H-pyran-2-yl}oxy)-3-methoxypropyl]-3,5-dimethyltetrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-methoxy-3,5,7,9,13-pentamethyloxacyclohenicosa-3,5,7,11,13-pentaen-2-on (non-preferred name); (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-4,6-dimethyltetrahydro-2H-pyran-2-yl}oxy)-3-methoxypropyl]-3,5-dimethyltetrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-methoxy-3,5,7,9,13-pentamethyloxacyclohenicosa-3,5,7,11,13-pentaen-2-one (non-preferred name); (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-méthoxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-4,6-diméthyltétrahydro-2H-pyran-2-yl}oxy)-3-méthoxypropyl]-3,5-diméthyltétrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-méthoxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-méthoxy-3,5,7,9,13-pentaméthyloxacyclohenicosa-3,5,7,11,13-pentaén-2-one (non-preferred name)
• 分子式: C₅₈H₉₆O₂₁
• 分子量: 1129.37
• CAS 登录号: 476647-30-0
• 分子行输入简码 SMILES: CC1/C=C(\C=C(/C=C(\C(=O)OC(C(CC(C(CC/C=C(\C=C/C1OC2C(C(C(C(O2)C)OC)O)O)/C)O)OC)O)C3(C(C(C(C(O3)CC(COC)OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)O)OC)(C)O)C)O)C)O)/C)\C)/C
• 国际化学标识码 InChI: 1S/C58H96O21/c1-29-17-16-18-40(59)44(69-13)25-41(60)54(78-55(65)33(5)23-31(3)21-30(2)22-32(4)42(20-19-29)76-56-51(64)50(63)52(71-15)37(9)74-56)58(67)35(7)48(61)34(6)43(79-58)24-39(28-68-12)75-47-27-57(11,66)53(38(10)73-47)77-46-26-45(70-14)49(62)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19-,29-17-,30-22-,31-21-,33-23-
• 国际化学标识检索码 InChIKey: BGIXVQPJBLGABA-BNPGMBDQSA-N

物理化学性质

• 密度: 1.3±0.1g/cm³ （计算值）
• 沸点: 1109.3±65.0°C at 760 mmHg （计算值）
• 闪点: 295.4±27.8°C （计算值）
• 折射率: 1.563 （计算值）