Chem
J-GLOBAL ID：200907001982508270   Nikkaji number：J1.658.000G

5-(6-O-α-L-Arabinofuranosyl-β-D-glucopyranosyloxy)-16,17-dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),9,14,16-heptene-3-ol

5-(6-O-α-L-アラビノフラノシル-β-D-グルコピラノシルオキシ)-16,17-ジメトキシトリシクロ[12.3.1.12,6]ノナデカ-1(18),2,4,6(19),9,14,16-ヘプタエン-3-オール
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： C32H42O13
Molecular formula furigana： C32-H42-O13
Molecular weight： 634.675
InChI： InChI=1S/C32H42O13/c1-40-22-11-16-8-6-4-3-5-7-9-17-12-18(19(10-16)30(22)41-2)20(34)13-21(17)43-32-29(39)27(37)26(36)24(45-32)15-42-31-28(38)25(35)23(14-33)44-31/h3,5,10-13,23-29,31-39H,4,6-9,14-15H2,1-2H3/t23-,24+,25-,26+,27-,28+,29+,31+,32+/m0/s1
InChI key： LLLGRIUBMQHHEY-FVNYEZTASA-N
SMILES： COc1cc2CCCC=CCCc3cc(c(O)cc3O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](CO)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(c2)c1OC
Systematic name  (3)：
  • 5-(6-O-α-L-アラビノフラノシル-β-D-グルコピラノシルオキシ)-16,17-ジメトキシトリシクロ[12.3.1.12,6]ノナデカ-1(18),2,4,6(19),9,14,16-ヘプタエン-3-オール
  • (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R,5S)-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]オキシ}メチル)-6-({3-ヒドロキシ-16,17-ジメトキシトリシクロ[12.3.1.12,6]ノナデカ-1(17),2,4,6(19),9,14(18),15-ヘプタエン-5-イル}オキシ)オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6S)-2-({[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-({3-hydroxy-16,17-dimethoxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),9,14(18),15-heptaen-5-yl}oxy)oxane-3,4,5-triol
Other name (1)：
  • 5-(6-O-α-L-Arabinofuranosyl-β-D-glucopyranosyloxy)-16,17-dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2,4,6(19),9,14,16-heptene-3-ol
Thsaurus map：
Thesaurus Map

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