芰皂毒素
[CAS# 4562-36-1]

基本信息

• 产品分类: 生物化工 >> 植物提取物
• 产品名称: 芰皂毒素
• 英文名: Gitoxin
• 别名: 4-[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-Dihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-14,16-Dihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-5H-Furan-2-One; 4-[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-3-[[(2R,4S,5S,6R)-5-[[(2S,4S,5S,6R)-5-[[(2S,4S,5S,6R)-4,5-Dihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-14,16-Dihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-5H-Furan-2-One; 4-[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-Dihydroxy-6-Methyl-Oxan-2-Yl]Oxy-4-Hydroxy-6-Methyl-Oxan-2-Yl]Oxy-4-Hydroxy-6-Methyl-Oxan-2-Yl]Oxy-14,16-Dihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-5H-Furan-2-One
• 分子式: C₄₁H₆₄O₁₄
• 分子量: 780.95
• CAS 登录号: 4562-36-1
• EINECS 登录号: 224-934-5
• 分子行输入简码 SMILES: [C@]68([C@H]5[C@@H]([C@@]4([C@@H](C[C@@H](O[C@H]3C[C@@H]([C@H](O[C@H]2C[C@@H]([C@H](O[C@H]1C[C@@H]([C@H](O)[C@H](O1)C)O)[C@H](O2)C)O)[C@H](O3)C)O)CC4)CC5)C)CC[C@@]6([C@@H](C7=CC(=O)OC7)[C@H](C8)O)C)O
• 国际化学标识码 InChI: 1S/C41H64O14/c1-19-36(47)27(42)14-33(50-19)54-38-21(3)52-34(16-29(38)44)55-37-20(2)51-32(15-28(37)43)53-24-8-10-39(4)23(13-24)6-7-26-25(39)9-11-40(5)35(22-12-31(46)49-18-22)30(45)17-41(26,40)48/h12,19-21,23-30,32-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25+,26-,27+,28+,29+,30+,32+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1
• 国际化学标识检索码 InChIKey: LKRDZKPBAOKJBT-CNPIRKNPSA-N

物理化学性质

• 密度: 1.364g/cm³ （计算值）
• 沸点: 931.961°C at 760 mmHg （计算值）
• 闪点: 278.647°C （计算值）