Linalool 3,6-Oxide 6-O-Xylopyranosylglucopyranoside
[CAS# 158799-49-6]

Identification

• Name: Linalool 3,6-Oxide 6-O-Xylopyranosylglucopyranoside
• Synonyms: (2S,3S,4S,5S,6R)-2-[1-Methyl-1-[(5R)-5-Methyl-5-Vinyl-Tetrahydrofuran-2-Yl]Ethoxy]-6-[[(2S,3R,4S,5R)-3,4,5-Trihydroxytetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-3,4,5-Triol; (2S,3S,4S,5S,6R)-2-[1-Methyl-1-[(5R)-5-Methyl-5-Vinyl-2-Tetrahydrofuranyl]Ethoxy]-6-[[(2S,3R,4S,5R)-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Oxymethyl]Tetrahydropyran-3,4,5-Triol; (2S,3S,4S,5S,6R)-2-[2-[(5R)-5-Ethenyl-5-Methyl-Oxolan-2-Yl]Propan-2-Yloxy]-6-[[(2S,3R,4S,5R)-3,4,5-Trihydroxyoxan-2-Yl]Oxymethyl]Oxane-3,4,5-Triol
• Molecular Formula: C₂₁H₃₆O₁₁
• Molecular Weight: 464.51
• CAS Registry Number: 158799-49-6
• SMILES: [C@@H]2(OC(C1O[C@](CC1)(C=C)C)(C)C)O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O)CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O
• InChI: 1S/C21H36O11/c1-5-21(4)7-6-12(31-21)20(2,3)32-19-17(27)15(25)14(24)11(30-19)9-29-18-16(26)13(23)10(22)8-28-18/h5,10-19,22-27H,1,6-9H2,2-4H3/t10-,11-,12?,13+,14-,15+,16-,17+,18+,19+,21+/m1/s1
• InChIKey: CXCRZTANOZWBHN-HYSWYBMCSA-N

Properties

• Density: 1.392g/cm³ (Cal.)
• Boiling point: 658.934°C at 760 mmHg (Cal.)
• Flash point: 352.311°C (Cal.)