Isomaltohexose
[CAS# 6175-02-6]

Identification

• Name: Isomaltohexose
• Synonyms: (2R,3S,4R,5R)-2,3,4,5-Tetrahydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxy-Hexanal; (2R,3S,4R,5R)-2,3,4,5-Tetrahydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl]Oxy]Hexanal; (2R,3S,4R,5R)-2,3,4,5-Tetrahydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxy-Hexanal
• Molecular Formula: C₃₆H₆₂O₃₁
• Molecular Weight: 990.87
• CAS Registry Number: 6175-02-6
• SMILES: [C@@H]4(OC[C@H]3O[C@H](OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](OC[C@H]1O[C@H](OC[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)[C@@H]([C@H]([C@@H]1O)O)O)O2)O)O)O)[C@@H]([C@H]([C@@H]3O)O)O)[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)CO)O)O)O
• InChI: 1S/C36H62O31/c37-1-8(39)15(41)16(42)9(40)3-58-32-28(54)23(49)18(44)11(64-32)5-60-34-30(56)25(51)20(46)13(66-34)7-62-36-31(57)26(52)21(47)14(67-36)6-61-35-29(55)24(50)19(45)12(65-35)4-59-33-27(53)22(48)17(43)10(2-38)63-33/h1,8-36,38-57H,2-7H2/t8-,9+,10+,11+,12+,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24-,25-,26-,27+,28+,29+,30+,31+,32-,33-,34-,35-,36-/m0/s1
• InChIKey: OITCGTKWORAONZ-UUCUGTBWSA-N

Properties

• Density: 1.84g/cm³ (Cal.)
• Boiling point: 1359.922°C at 760 mmHg (Cal.)
• Flash point: 401.145°C (Cal.)