N-[(2R,3R,4R,5S,6R)-4-{[(2S,3R,4S,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3-乙酰氨基-4,5-二羟基-6-(羟基甲基)四氢-2H-吡喃-2-基]氧基}-4-羟基-3-(羟基甲基)-6-{[(2S,3S,4R,5S,6S)-3,4,5-三羟基-6-甲基四氢-2H-吡喃-2-基]氧基}四氢-2H-吡喃-2-基]氧基}-2-{[(2R,3S,4S,5R,6S)-3,5-二羟基-2-(羟基甲基)-6-{[(2R,4R,5R)-1,2,4,5-四羟基-6-氧代-3-己烷基]氧基}四氢-2H-吡喃-4-yl]氧基}-5-羟基-6-(羟基甲基)四氢-2H-吡喃-3-基]乙酰胺
[CAS# 88972-42-3]

基本信息

• 产品名称: N-[(2R,3R,4R,5S,6R)-4-{[(2S,3R,4S,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3-乙酰氨基-4,5-二羟基-6-(羟基甲基)四氢-2H-吡喃-2-基]氧基}-4-羟基-3-(羟基甲基)-6-{[(2S,3S,4R,5S,6S)-3,4,5-三羟基-6-甲基四氢-2H-吡喃-2-基]氧基}四氢-2H-吡喃-2-基]氧基}-2-{[(2R,3S,4S,5R,6S)-3,5-二羟基-2-(羟基甲基)-6-{[(2R,4R,5R)-1,2,4,5-四羟基-6-氧代-3-己烷基]氧基}四氢-2H-吡喃-4-yl]氧基}-5-羟基-6-(羟基甲基)四氢-2H-吡喃-3-基]乙酰胺
• 英文名: N-[(2R,3R,4R,5S,6R)-4-{[(2S,3R,4S,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-4-hydroxy-3-(hydroxymethyl)-6-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy -6-methyltetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-2-{[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-{[(2R,4R,5R)-1,2,4,5-tetrahydroxy-6-oxo-3-hexanyl]oxy}tetrahydro-2H-pyran-4-y l]oxy}-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]acetamide
• 分子式: C₄₀H₆₈N₂O₃₀
• 分子量: 1056.96
• CAS 登录号: 88972-42-3
• 分子行输入简码 SMILES: O=C[C@H](O)[C@@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](OC4O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H](O)[C@H]3CO)[C@H]4NC(C)=O)[C@H]5O)[C@H](O)CO
• 国际化学标识码 InChI: 1S/C40H68N2O30/c1-10-21(53)28(60)29(61)38(63-10)72-40-34(70-36-19(41-11(2)49)27(59)24(56)16(7-46)64-36)22(54)13(4-43)35(71-40)68-32-20(42-12(3)50)37(65-17(8-47)25(32)57)69-33-26(58)18(9-48)66-39(30(33)62)67-31(15(52)6-45)23(55)14(51)5-44/h5,10,13-40,43,45-48,51-62H,4,6-9H2,1-3H3,(H,41,49)(H,42,50)/t10-,13+,14-,15+,16+,17+,18+,19+,20+,21+,22-,23+,24-,25+,26-,27+,28+,29-,30+,31+,32+,33-,34-,35-,36?,37?,38-,39-,40+/m0/s1
• 国际化学标识检索码 InChIKey: HPEZEWDVZCZHFV-DVLLRCRMSA-N

物理化学性质

• 密度: 1.708g/cm³ （计算值）
• 沸点: 1440.848°C at 760 mmHg （计算值）
• 闪点: 825.195°C （计算值）