beta-D-Fructofuranosyl (Z)-9-Octadecenoate alpha-D-Glucopyranoside
[CAS# 52683-61-1]

Identification

• Name: beta-D-Fructofuranosyl (Z)-9-Octadecenoate alpha-D-Glucopyranoside
• Synonyms: [(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)Tetrahydrofuran-2-Yl]-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl] (Z)-Octadec-9-Enoate; (Z)-Octadec-9-Enoic Acid [(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)-2-Tetrahydrofuranyl]-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl] Ester; (Z)-Octadec-9-Enoic Acid [(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Dimethylol-Tetrahydrofuran-2-Yl]-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl] Ester
• Molecular Formula: C₃₀H₅₄O₁₂
• Molecular Weight: 606.75
• CAS Registry Number: 52683-61-1
• EINECS: 258-098-8
• SMILES: [C@]1(O[C@@H]([C@@H](O)[C@@H]1O)CO)([C@@]2(O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)OC(=O)CCCCCCC\C=C/CCCCCCCC)CO
• InChI: 1S/C30H54O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(34)42-30(28(39)26(37)24(35)21(18-31)41-30)29(20-33)27(38)25(36)22(19-32)40-29/h9-10,21-22,24-28,31-33,35-39H,2-8,11-20H2,1H3/b10-9-/t21-,22-,24-,25-,26+,27+,28-,29+,30+/m1/s1
• InChIKey: AECIIQVDGKYLNI-VUAWYJOHSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 772.014°C at 760 mmHg (Cal.)
• Flash point: 239.482°C (Cal.)