牛磺-24,25-二氢褐霉素
[CAS# 53163-88-5]

基本信息

• 产品名称: 牛磺-24,25-二氢褐霉素
• 英文名: Tauro-24,25-Dihydrofusidate
• 别名: 2-[[(2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-Acetoxy-3,11-Dihydroxy-4,8,10,14-Tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Ylidene]-6-Methyl-Heptanoyl]Amino]Acetic Acid; 2-[[(2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-Acetoxy-3,11-Dihydroxy-4,8,10,14-Tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Ylidene]-6-Methyl-1-Oxoheptyl]Amino]Acetic Acid; 2-[[(2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-Acetyloxy-3,11-Dihydroxy-4,8,10,14-Tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Ylidene]-6-Methyl-Heptanoyl]Amino]Ethanoic Acid
• 分子式: C₃₃H₅₃NO₇
• 分子量: 575.78
• CAS 登录号: 53163-88-5
• 分子行输入简码 SMILES: [C@]13([C@H]([C@@]2([C@@H](CC1)[C@@H]([C@H](O)CC2)C)C)[C@H](O)C[C@@H]\4[C@@]3(C[C@H](OC(=O)C)C4=C(C(=O)NCC(=O)O)/CCCC(C)C)C)C
• 国际化学标识码 InChI: 1S/C33H53NO7/c1-18(2)9-8-10-21(30(40)34-17-27(38)39)28-23-15-25(37)29-31(5)13-12-24(36)19(3)22(31)11-14-32(29,6)33(23,7)16-26(28)41-20(4)35/h18-19,22-26,29,36-37H,8-17H2,1-7H3,(H,34,40)(H,38,39)/b28-21-/t19-,22-,23-,24+,25+,26-,29-,31-,32-,33-/m0/s1
• 国际化学标识检索码 InChIKey: RDDQYPXUIDIYTL-AREPUUQJSA-N

物理化学性质

• 密度: 1.182g/cm³ （计算值）
• 沸点: 721.798°C at 760 mmHg （计算值）
• 闪点: 390.33°C （计算值）