Chem
J-GLOBAL ID：200907056278842407   Nikkaji number：J615.023C

4-(4-O-Acetyl-α-L-rhamnosyloxy)benzyl isothiocyanate

4-(4-O-アセチル-α-L-ラムノシルオキシ)ベンジルイソチオシアナート
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H19NO6S
Molecular formula furigana： C16-H19-N-O6-S
Molecular weight： 353.390
InChI： InChI=1S/C16H19NO6S/c1-9-15(22-10(2)18)13(19)14(20)16(21-9)23-12-5-3-11(4-6-12)7-17-8-24/h3-6,9,13-16,19-20H,7H2,1-2H3/t9-,13-,14+,15-,16-/m0/s1
InChI key： WVUZLAMBBZISKM-QOYUQHOESA-N
SMILES： C[C@@H]1O[C@@H](Oc2ccc(CN=C=S)cc2)[C@H](O)[C@H](O)[C@H]1OC(=O)C
Systematic name  (5)：
  • [4-[(4-O-アセチル-6-デオキシ-α-L-マンノピラノシル)オキシ]ベンジル]イソチオシアナート
  • 4-(4-O-アセチル-α-L-ラムノピラノシルオキシ)ベンジルイソチオシアナート
  • 4-(4-O-アセチル-α-L-ラムノシルオキシ)ベンジルイソチオシアナート
  • (2S,3R,4S,5R,6S)-4,5-ジヒドロキシ-6-[4-(イソチオシアナトメチル)フェノキシ]-2-メチルオキサン-3-イル アセタート
  • (2S,3R,4S,5R,6S)-4,5-dihydroxy-6-[4-(isothiocyanatomethyl)phenoxy]-2-methyloxan-3-yl acetate
Other name (3)：
  • [4-[(4-O-Acetyl-6-deoxy-α-L-mannopyranosyl)oxy]benzyl] isothiocyanate
  • 4-(4-O-Acetyl-α-L-rhamnopyranosyloxy)benzyl isothiocyanate
  • 4-(4-O-Acetyl-α-L-rhamnosyloxy)benzyl isothiocyanate
Thsaurus map：
Thesaurus Map

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