(1S)-1alpha-(beta-D-Glucopyranosyloxy)-1,4aalpha,5,7aalpha-Tetrahydro-7-Hydroxymethyl-Cyclopenta[c]Pyran-4-Carbaldehyde
[CAS# 61081-59-2]

Identification

• Name: (1S)-1alpha-(beta-D-Glucopyranosyloxy)-1,4aalpha,5,7aalpha-Tetrahydro-7-Hydroxymethyl-Cyclopenta[c]Pyran-4-Carbaldehyde
• Synonyms: (1S,4As,7As)-7-(Hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-1,4A,5,7A-Tetrahydrocyclopenta[D]Pyran-4-Carbaldehyde; (1S,4As,7As)-7-(Hydroxymethyl)-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-1,4A,5,7A-Tetrahydrocyclopenta[D]Pyran-4-Carboxaldehyde; (1S,4As,7As)-7-Methylol-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-1,4A,5,7A-Tetrahydrocyclopenta[D]Pyran-4-Carbaldehyde
• Molecular Formula: C₁₆H₂₂O₉
• Molecular Weight: 358.34
• CAS Registry Number: 61081-59-2
• SMILES: [C@@H]1([C@H]2[C@@H](C(=CO1)C=O)CC=C2CO)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O3)CO
• InChI: 1S/C16H22O9/c17-3-7-1-2-9-8(4-18)6-23-15(11(7)9)25-16-14(22)13(21)12(20)10(5-19)24-16/h1,4,6,9-17,19-22H,2-3,5H2/t9-,10-,11-,12-,13+,14-,15+,16+/m1/s1
• InChIKey: CSSBAEZXGJABKW-SWZHBTMOSA-N

Properties

• Density: 1.56g/cm³ (Cal.)
• Boiling point: 645.685°C at 760 mmHg (Cal.)
• Flash point: 237.698°C (Cal.)