Majoroside F5
[CAS# 125309-99-1]

Identification

• Name: Majoroside F5
• Synonyms: (2S,3R,4S,5S,6R)-2-[(E,1S)-1-[(6R,10R,12S,14R,17S)-6-[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-3,12-Dihydroxy-4,4,10,14-Tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-4-Hydroxy-1,5-Dimethyl-Hex-2-Enoxy]-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; (2S,3R,4S,5S,6R)-2-[(E,1S)-1-[(6R,10R,12S,14R,17S)-6-[[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-3,12-Dihydroxy-4,4,10,14-Tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-4-Hydroxy-1,5-Dimethylhex-2-Enoxy]-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; (2S,3R,4S,5S,6R)-2-[(E,1S)-1-[(6R,10R,12S,14R,17S)-6-[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-Methylol-3-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-3,12-Dihydroxy-4,4,10,14-Tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl]-4-Hydroxy-1,5-Dimethyl-Hex-2-Enoxy]-6-Methylol-Tetrahydropyran-3,4,5-Triol
• Molecular Formula: C₄₇H₈₀O₁₉
• Molecular Weight: 949.14
• CAS Registry Number: 125309-99-1
• SMILES: [C@]23(C([C@@H]([C@@](O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)(\C=C\C(O)C(C)C)C)CC2)[C@@H](O)CC6C3C[C@@H](O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@H]([C@H](O)[C@@H](O)[C@H]5O)C)CO)C7[C@@]6(CCC(O)C7(C)C)C)C
• InChI: 1S/C47H80O19/c1-19(2)24(50)10-14-47(8,66-42-38(60)35(57)32(54)27(17-48)63-42)21-9-12-45(6)23-16-26(40-44(4,5)29(52)11-13-46(40,7)22(23)15-25(51)30(21)45)62-43-39(36(58)33(55)28(18-49)64-43)65-41-37(59)34(56)31(53)20(3)61-41/h10,14,19-43,48-60H,9,11-13,15-18H2,1-8H3/b14-10+/t20-,21-,22?,23?,24?,25-,26+,27+,28+,29?,30?,31-,32+,33+,34+,35-,36-,37+,38+,39+,40?,41-,42-,43+,45+,46+,47-/m0/s1
• InChIKey: HJAUCZRAVQFECY-GBRBAAPOSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 1045.6°C at 760 mmHg (Cal.)
• Flash point: 586.158°C (Cal.)