Triglochinin
[CAS# 28876-11-1]

Identification

• Name: Triglochinin
• Synonyms: (Z,4E)-4-[Cyano-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Methylene]Hex-2-Enedioic Acid; (Z,4E)-4-[Cyano-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Methylene]Hex-2-Enedioic Acid; (Z,4E)-4-[Cyano-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Methylene]Hex-2-Enedioic Acid
• Molecular Formula: C₁₄H₁₇NO₁₀
• Molecular Weight: 359.29
• CAS Registry Number: 28876-11-1
• SMILES: [C@H]1(O)[C@H](O)[C@@H](O)[C@@H](O[C@@H]1CO)O\C(=C(CC(O)=O)\C=C/C(O)=O)C#N
• InChI: 1S/C14H17NO10/c15-4-7(6(3-10(19)20)1-2-9(17)18)24-14-13(23)12(22)11(21)8(5-16)25-14/h1-2,8,11-14,16,21-23H,3,5H2,(H,17,18)(H,19,20)/b2-1-,7-6-/t8-,11-,12+,13-,14-/m1/s1
• InChIKey: LABCALMTQNDOAI-PKNBYVPASA-N