Chem
J-GLOBAL ID：201007034244724739   Nikkaji number：J2.874.551F

KankanosideM

カンカノシドM
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： C15H22O8
Molecular formula furigana： C15-H22-O8
Molecular weight： 330.333
InChI： InChI=1S/C15H22O8/c16-5-9-11(17)12(18)13(19)15(23-9)22-6-8-2-1-7-3-4-21-14(20)10(7)8/h2,7,9-13,15-19H,1,3-6H2/t7-,9-,10+,11-,12+,13-,15-/m1/s1
InChI key： YIYHUWVUNODKTC-KJCLABKISA-N
SMILES： OC[C@H]1O[C@@H](OCC2=CC[C@@H]3CCOC(=O)[C@H]23)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • (4aR)-7-(β-D-グルコピラノシルオキシメチル)-1,3,4,4aα,5,7aα-ヘキサヒドロシクロペンタ[c]ピラン-1-オン
  • (4aR,7aS)-7-({[(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}メチル)-1H,3H,4H,4aH,5H,7aH-シクロペンタ[c]ピラン-1-オン
  • (4aR,7aS)-7-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-1H,3H,4H,4aH,5H,7aH-cyclopenta[c]pyran-1-one
Other name (3)：
  • (4aR)-7-(β-D-Glucopyranosyloxymethyl)-1,3,4,4aα,5,7aα-hexahydrocyclopenta[c]pyran-1-one
  • カンカノシドM
  • KankanosideM
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