Limonin 17-beta-D-glucopyranoside
[CAS# 123564-61-4]

Identification

• Name: Limonin 17-beta-D-glucopyranoside
• Synonyms: Limonin 17-Beta-D-Glucopyranoside
• Molecular Formula: C₃₂H₄₂O₁₄
• Molecular Weight: 650.68
• CAS Registry Number: 123564-61-4
• SMILES: C7=C(C(C5(C1(C(C(=O)O)O1)C3(C(C24C(OC(C2CC3=O)(C)C)CC(OC4)=O)CC5)C)C)OC6C(C(O)C(C(O6)CO)O)O)C=CO7
• InChI: 1S/C32H42O14/c1-28(2)17-9-18(34)30(4)16(31(17)13-42-20(35)10-19(31)45-28)5-7-29(3,32(30)25(46-32)26(39)40)24(14-6-8-41-12-14)44-27-23(38)22(37)21(36)15(11-33)43-27/h6,8,12,15-17,19,21-25,27,33,36-38H,5,7,9-11,13H2,1-4H3,(H,39,40)
• InChIKey: FYIKIBQJAJRKQM-UHFFFAOYSA-N

Properties

• Density: 1.515g/cm³ (Cal.)
• Boiling point: 866.773°C at 760 mmHg (Cal.)
• Flash point: 478.007°C (Cal.)