Chem
J-GLOBAL ID：200907058601840020   Nikkaji number：J1.704.493A

Turpinionoside D

ツルピニオノシド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： C19H34O8
Molecular formula furigana： C19-H34-O8
Molecular weight： 390.473
InChI： InChI=1S/C19H34O8/c1-9(21)5-6-11-10(2)14(22)12(7-19(11,3)4)26-18-17(25)16(24)15(23)13(8-20)27-18/h9,12-18,20-25H,5-8H2,1-4H3/t9-,12+,13-,14-,15-,16+,17-,18-/m1/s1
InChI key： QYRQYBHQCMVSQX-NOPABDHCSA-N
SMILES： C[C@@H](O)CCC1=C(C)[C@@H](O)[C@H](CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (1R)-2,4,4-トリメチル-3-[(3R)-3-ヒドロキシブチル]-6α-(β-D-グルコピラノシルオキシ)-2-シクロヘキセン-1α-オール
  • (2R,3R,4S,5S,6R)-2-{[(1S,2R)-2-ヒドロキシ-4-[(3R)-3-ヒドロキシブチル]-3,5,5-トリメチルシクロヘキサ-3-エン-1-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-{[(1S,2R)-2-hydroxy-4-[(3R)-3-hydroxybutyl]-3,5,5-trimethylcyclohex-3-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (3)：
  • (1R)-2,4,4-Trimethyl-3-[(3R)-3-hydroxybutyl]-6α-(β-D-glucopyranosyloxy)-2-cyclohexene-1α-ol
  • ツルピニオノシドD
  • Turpinionoside D
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