Chem
J-GLOBAL ID：200907098155752980   Nikkaji number：J1.443.905F

Myrsinionoside D

ミルシニオノシドD
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： C19H36O7
Molecular formula furigana： C19-H36-O7
Molecular weight： 376.490
InChI： InChI=1S/C19H36O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h10-18,20-24H,5-9H2,1-4H3/t10-,11-,12+,13+,14-,15-,16+,17-,18-/m1/s1
InChI key： IOICPLCBYINMDA-XEDNMXAHSA-N
SMILES： C[C@H](CC[C@H]1[C@H](C)C[C@H](O)CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • [(R)-3-[(1S,4S,6R)-4-ヒドロキシ-2,2,6-トリメチルシクロヘキシル]-1-メチルプロピル]β-D-グルコピラノシド
  • (1S)-3,3,5α-トリメチル-4β-[(R)-3-(β-D-グルコピラノシルオキシ)ブチル]シクロヘキサン-1α-オール
  • (2R,3R,4S,5S,6R)-2-{[(2R)-4-[(1S,4S,6R)-4-ヒドロキシ-2,2,6-トリメチルシクロヘキシル]ブタン-2-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2R,3R,4S,5S,6R)-2-{[(2R)-4-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethylcyclohexyl]butan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (4)：
  • [(R)-3-[(1S,4S,6R)-4-Hydroxy-2,2,6-trimethylcyclohexyl]-1-methylpropyl]β-D-glucopyranoside
  • (1S)-3,3,5α-Trimethyl-4β-[(R)-3-(β-D-glucopyranosyloxy)butyl]cyclohexane-1α-ol
  • ミルシニオノシドD
  • Myrsinionoside D
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