Chem
J-GLOBAL ID：201007072003322744   Nikkaji number：J2.874.552D

KankanosideN

カンカノシドN
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： C16H28O8
Molecular formula furigana： C16-H28-O8
Molecular weight： 348.392
InChI： InChI=1S/C16H28O8/c1-7-2-3-9-8(5-22-15(21)11(7)9)6-23-16-14(20)13(19)12(18)10(4-17)24-16/h7-21H,2-6H2,1H3/t7-,8-,9-,10-,11-,12-,13+,14-,15-,16-/m1/s1
InChI key： XEGBTSBHYDKUHG-IDESIXDGSA-N
SMILES： C[C@@H]1CC[C@H]2[C@@H]1[C@H](O)OC[C@@H]2CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (1R,4aα,7aα)-4α-(β-D-グルコピラノシルオキシメチル)-7β-メチルオクタヒドロシクロペンタ[c]ピラン-1α-オール
  • (2R,3R,4S,5S,6R)-2-{[(1R,4R,4aR,7R,7aR)-1-ヒドロキシ-7-メチル-オクタヒドロシクロペンタ[c]ピラン-4-イル]メトキシ}-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-{[(1R,4R,4aR,7R,7aR)-1-hydroxy-7-methyl-octahydrocyclopenta[c]pyran-4-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (3)：
  • (1R,4aα,7aα)-4α-(β-D-Glucopyranosyloxymethyl)-7β-methyloctahydrocyclopenta[c]pyran-1α-ol
  • カンカノシドN
  • KankanosideN
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