Chem
J-GLOBAL ID：200907031813596230   Nikkaji number：J2.231.579J

Zingiberoside B

ジンギベロシドB
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： C21H36O11
Molecular formula furigana： C21-H36-O11
Molecular weight： 464.508
InChI： InChI=1S/C21H36O11/c1-19(2)9-4-12(20(19,3)5-10(9)23)32-17-15(26)14(25)13(24)11(31-17)6-29-18-16(27)21(28,7-22)8-30-18/h9-18,22-28H,4-8H2,1-3H3/t9-,10+,11+,12-,13+,14-,15+,16-,17-,18+,20-,21+/m0/s1
InChI key： BVEVSYQMQABMQM-KPSFXTQJSA-N
SMILES： CC1(C)[C@H]2C[C@H](O[C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)[C@]1(C)C[C@H]2O
Systematic name  (3)：
  • (1R,4R)-2β-[6-O-(D-アピオ-β-D-フラノシル)-β-D-グルコピラノシルオキシ]ボルナン-5α-オール
  • (2R,3S,4S,5R,6R)-2-({[(2R,3R,4R)-3,4-ジヒドロキシ-4-(ヒドロキシメチル)オキソラン-2-イル]オキシ}メチル)-6-{[(1R,2S,4R,5R)-5-ヒドロキシ-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-イル]オキシ}オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6R)-2-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(1R,2S,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl]oxy}oxane-3,4,5-triol
Other name (3)：
  • (1R,4R)-2β-[6-O-(D-Apio-β-D-furanosyl)-β-D-glucopyranosyloxy]bornane-5α-ol
  • ジンギベロシドB
  • Zingiberoside B
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