Chem
J-GLOBAL ID：200907079359261646   Nikkaji number：J1.055.648A

Seguinoside B

セグイノシドB
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： C17H24O11
Molecular formula furigana： C17-H24-O11
Molecular weight： 404.368
InChI： InChI=1S/C17H24O11/c18-6-17(24)7-26-16(14(17)23)25-5-10-11(20)12(21)13(22)15(28-10)27-9-3-1-8(19)2-4-9/h1-4,10-16,18-24H,5-7H2/t10-,11-,12+,13-,14+,15-,16-,17-/m1/s1
InChI key： MJAVHXIMPOPFJG-DCSNAHRYSA-N
SMILES： OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@@H](Oc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O
Systematic name  (3)：
  • 4-ヒドロキシフェニル6-O-D-アピオ-β-D-フラノシル-β-D-グルコピラノシド
  • (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R)-3,4-ジヒドロキシ-4-(ヒドロキシメチル)オキソラン-2-イル]オキシ}メチル)-6-(4-ヒドロキシフェノキシ)オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
Other name (3)：
  • 4-Hydroxyphenyl 6-O-D-apio-β-D-furanosyl-β-D-glucopyranoside
  • セグイノシドB
  • Seguinoside B
Thsaurus map：
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