(2S)-3-Methyl-2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-Trihydroxyoxan-2-Yl]Oxymethyl]Oxan-2-Yl]Oxybut-3-Enenitrile
[CAS# 79197-21-0]

Identification

• Name: (2S)-3-Methyl-2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-Trihydroxyoxan-2-Yl]Oxymethyl]Oxan-2-Yl]Oxybut-3-Enenitrile
• Synonyms: (2S)-3-Methyl-2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-Trihydroxytetrahydropyran-2-Yl]Oxymethyl]Tetrahydropyran-2-Yl]Oxy-But-3-Enenitrile; (2S)-3-Methyl-2-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Oxymethyl]-2-Tetrahydropyranyl]Oxy]But-3-Enenitrile; (2S)-3-Methyl-2-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-Trihydroxyoxan-2-Yl]Oxymethyl]Oxan-2-Yl]Oxy-But-3-Enenitrile
• Molecular Formula: C₁₆H₂₅NO₁₀
• Molecular Weight: 391.37
• CAS Registry Number: 79197-21-0
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO[C@H]2[C@@H]([C@@H](O)[C@H](CO2)O)O)O)O)O[C@H](C#N)C(=C)C
• InChI: 1S/C16H25NO10/c1-6(2)8(3-17)26-16-14(23)12(21)11(20)9(27-16)5-25-15-13(22)10(19)7(18)4-24-15/h7-16,18-23H,1,4-5H2,2H3/t7-,8+,9+,10-,11+,12-,13+,14+,15-,16+/m0/s1
• InChIKey: BHUCUDQLYLLDIA-ZHFVSHRQSA-N