(1S,4aS,7R,7aR)-7-Methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-1,4q,5,6,7,7a-Hexahydrocyclopenta[d]Pyran-4-Carbaldehyde
[CAS# 72963-55-4]

Identification

• Name: (1S,4aS,7R,7aR)-7-Methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-1,4q,5,6,7,7a-Hexahydrocyclopenta[d]Pyran-4-Carbaldehyde
• Synonyms: (1S,4As,7R,7Ar)-7-Methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-1,4A,5,6,7,7A-Hexahydrocyclopenta[D]Pyran-4-Carbaldehyde; (1S,4As,7R,7Ar)-7-Methyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-1,4A,5,6,7,7A-Hexahydrocyclopenta[D]Pyran-4-Carboxaldehyde; (1S,4As,7R,7Ar)-7-Methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-1,4A,5,6,7,7A-Hexahydrocyclopenta[D]Pyran-4-Carbaldehyde
• Molecular Formula: C₁₆H₂₄O₈
• Molecular Weight: 344.36
• CAS Registry Number: 72963-55-4
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO)O)O)O[C@H]3[C@H]2[C@H](CC[C@H]2C)C(=CO3)C=O
• InChI: 1S/C16H24O8/c1-7-2-3-9-8(4-17)6-22-15(11(7)9)24-16-14(21)13(20)12(19)10(5-18)23-16/h4,6-7,9-16,18-21H,2-3,5H2,1H3/t7-,9-,10-,11-,12-,13+,14-,15+,16+/m1/s1
• InChIKey: MRIFZKMKTDPBHR-XLOWEYQUSA-N

Properties

• Density: 1.436g/cm³ (Cal.)
• Boiling point: 560.751°C at 760 mmHg (Cal.)
• Flash point: 204.733°C (Cal.)