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Linamarin
[CAS# 554-35-8]

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Identification
Name Linamarin
Synonyms 2-Methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Propanenitrile; 2-Methyl-2-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Propanenitrile; 2-Methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Propionitrile
Molecular Structure CAS#: 554-35-8, Linamarin
Molecular Formula C10H17NO6
Molecular Weight 247.25
CAS Registry Number 554-35-8
SMILES [C@@H]1([C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC(C#N)(C)C
InChI 1S/C10H17NO6/c1-10(2,4-11)17-9-8(15)7(14)6(13)5(3-12)16-9/h5-9,12-15H,3H2,1-2H3/t5-,6-,7+,8-,9+/m1/s1
InChIKey QLTCHMYAEJEXBT-ZEBDFXRSSA-N
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