2-[(2Z,5Z,7Z,9R,10R,11Z)-13-Hydroxy-3,7,9,11-Tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxytrideca-2,5,7,11-Tetraenyl]-5,6-Dimethoxy-3-Methyl-1H-Pyridin-4-One
[CAS# 132150-13-1]

Identification

• Name: 2-[(2Z,5Z,7Z,9R,10R,11Z)-13-Hydroxy-3,7,9,11-Tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxytrideca-2,5,7,11-Tetraenyl]-5,6-Dimethoxy-3-Methyl-1H-Pyridin-4-One
• Synonyms: 2-[(2Z,5Z,7Z,9R,10R,11Z)-13-Hydroxy-3,7,9,11-Tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Trideca-2,5,7,11-Tetraenyl]-5,6-Dimethoxy-3-Methyl-1H-Pyridin-4-One; 2-[(2Z,5Z,7Z,9R,10R,11Z)-13-Hydroxy-3,7,9,11-Tetramethyl-10-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Trideca-2,5,7,11-Tetraenyl]-5,6-Dimethoxy-3-Methyl-1H-Pyridin-4-One; 2-[(2Z,5Z,7Z,9R,10R,11Z)-13-Hydroxy-3,7,9,11-Tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Trideca-2,5,7,11-Tetraenyl]-5,6-Dimethoxy-3-Methyl-4-Pyridone
• Molecular Formula: C₃₁H₄₇NO₁₀
• Molecular Weight: 593.71
• CAS Registry Number: 132150-13-1
• SMILES: [C@H]2(O)[C@H](O)[C@H](O[C@@H](O[C@H]([C@H](C)\C=C(C)/C=C\C\C(=C/CC1=C(C(=O)C(=C(OC)N1)OC)C)C)\C(C)=C/CO)[C@@H]2O)CO
• InChI: 1S/C31H47NO10/c1-17(11-12-22-21(5)24(35)29(39-6)30(32-22)40-7)9-8-10-18(2)15-20(4)28(19(3)13-14-33)42-31-27(38)26(37)25(36)23(16-34)41-31/h8,10-11,13,15,20,23,25-28,31,33-34,36-38H,9,12,14,16H2,1-7H3,(H,32,35)/b10-8-,17-11-,18-15-,19-13-/t20-,23-,25-,26+,27-,28+,31+/m1/s1
• InChIKey: ZNDBGWYPOYJCKZ-KQTYKWADSA-N

Properties

• Density: 1.249g/cm³ (Cal.)
• Boiling point: 825.88°C at 760 mmHg (Cal.)
• Flash point: 453.276°C (Cal.)