Chem
J-GLOBAL ID:200907077322403855   Nikkaji number:J2.226.870H

Genameside C

ゲナメシドC
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: C23H34O15
Molecular formula furigana: C23-H34-O15
Molecular weight: 550.510
InChI: InChI=1S/C23H34O15/c1-33-20(32)10-7-34-21(13-8(4-24)2-3-9(10)13)38-23-18(31)16(29)19(12(6-26)36-23)37-22-17(30)15(28)14(27)11(5-25)35-22/h2,7,9,11-19,21-31H,3-6H2,1H3/t9-,11-,12-,13-,14-,15+,16-,17-,18-,19-,21+,22+,23+/m1/s1
InChI key: JRYVBZDSFXDJAN-NWTASXAMSA-N
SMILES: COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1CC=C2CO
Systematic name  (3):
  • (1S)-1α-(4-O-β-D-グルコピラノシル-β-D-グルコピラノシルオキシ)-1,4aα,5,7aα-テトラヒドロ-7-(ヒドロキシメチル)シクロペンタ[c]ピラン-4-カルボン酸メチル
  • メチル (1S,4aS,7aS)-1-{[(2S,3R,4R,5S,6R)-3,4-ジヒドロキシ-6-(ヒドロキシメチル)-5-{[(2S,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}オキサン-2-イル]オキシ}-7-(ヒドロキシメチル)-1H,4aH,5H,7aH-シクロペンタ[c]ピラン-4-カルボキシラート
  • methyl (1S,4aS,7aS)-1-{[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7-(hydroxymethyl)-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylate
Other name (3):
  • (1S)-1α-(4-O-β-D-Glucopyranosyl-β-D-glucopyranosyloxy)-1,4aα,5,7aα-tetrahydro-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid methyl ester
  • ゲナメシドC
  • Genameside C
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