Chem
J-GLOBAL ID:200907083069196856   Nikkaji number:J2.068.871H

2-[(Z)-5-(β-D-Glucopyranosyloxy)-2-pentenyl]-3-methyl-2-cyclopentene-1-one

2-[(Z)-5-(β-D-グルコピラノシルオキシ)-2-ペンテニル]-3-メチル-2-シクロペンテン-1-オン
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: C17H26O7
Molecular formula furigana: C17-H26-O7
Molecular weight: 342.388
InChI: InChI=1S/C17H26O7/c1-10-6-7-12(19)11(10)5-3-2-4-8-23-17-16(22)15(21)14(20)13(9-18)24-17/h2-3,13-18,20-22H,4-9H2,1H3/b3-2-/t13-,14-,15+,16-,17-/m1/s1
InChI key: GQQXMGOLSQFKPZ-ODWDTFMPSA-N
SMILES: CC1=C(C/C=C\CCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)CC1
Systematic name  (3):
  • 2-[(Z)-5-(β-D-グルコピラノシルオキシ)-2-ペンテニル]-3-メチル-2-シクロペンテン-1-オン
  • 3-メチル-2-[(2Z)-5-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}ペンタ-2-エン-1-イル]シクロペンタ-2-エン-1-オン
  • 3-methyl-2-[(2Z)-5-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pent-2-en-1-yl]cyclopent-2-en-1-one
Other name (1):
  • 2-[(Z)-5-(β-D-Glucopyranosyloxy)-2-pentenyl]-3-methyl-2-cyclopentene-1-one
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