(2E)-15-Hydroxy-11-Methyl-17-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-12-Oxabicyclo[12.4.0]Octadeca-1(18),2,14,16-Tetraene-7,13-Dione
[CAS# 105088-14-0]

Identification

• Name: (2E)-15-Hydroxy-11-Methyl-17-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-12-Oxabicyclo[12.4.0]Octadeca-1(18),2,14,16-Tetraene-7,13-Dione
• Synonyms: (2E)-15-Hydroxy-11-Methyl-17-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-12-Oxabicyclo[12.4.0]Octadeca-1(18),2,14,16-Tetraene-7,13-Dione; (2E)-15-Hydroxy-11-Methyl-17-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-12-Oxabicyclo[12.4.0]Octadeca-1(18),2,14,16-Tetraene-7,13-Dione; (2E)-15-Hydroxy-11-Methyl-17-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-12-Oxabicyclo[12.4.0]Octadeca-1(18),2,14,16-Tetraene-7,13-Quinone
• Molecular Formula: C₂₄H₃₂O₁₀
• Molecular Weight: 480.51
• CAS Registry Number: 105088-14-0
• SMILES: C2=C(OC1OC(C(O)C(O)C1O)CO)C=C(O)C3=C2\C=C\CCCC(=O)CCCC(OC3=O)C
• InChI: 1S/C24H32O10/c1-13-6-5-9-15(26)8-4-2-3-7-14-10-16(11-17(27)19(14)23(31)32-13)33-24-22(30)21(29)20(28)18(12-25)34-24/h3,7,10-11,13,18,20-22,24-25,27-30H,2,4-6,8-9,12H2,1H3/b7-3+
• InChIKey: WHIQFPVDPPLAOJ-XVNBXDOJSA-N

Properties

• Density: 1.331g/cm³ (Cal.)
• Boiling point: 803.095°C at 760 mmHg (Cal.)
• Flash point: 273.071°C (Cal.)