Chem
J-GLOBAL ID：200907015456862001   Nikkaji number：J739.936G

Kelampayoside B

ケランパヨシド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： C29H36O16
Molecular formula furigana： C29-H36-O16
Molecular weight： 640.591
InChI： InChI=1S/C29H36O16/c1-38-18-9-15(10-19(39-2)25(18)40-3)44-27-24(35)23(34)22(33)20(45-27)11-41-28-26(36)29(37,13-43-28)12-42-21(32)7-5-14-4-6-16(30)17(31)8-14/h4-10,20,22-24,26-28,30-31,33-37H,11-13H2,1-3H3/b7-5+/t20-,22-,23+,24-,26+,27-,28-,29-/m1/s1
InChI key： CKCXDLPHBUFZPH-YVQWANQJSA-N
SMILES： COc1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(COC(=O)/C=C/c4ccc(O)c(O)c4)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC
Systematic name  (4)：
  • 3,4,5-トリメトキシフェニル6-O-[5-O-[(E)-3-(3,4-ジヒドロキシフェニル)プロペノイル]-D-アピオ-β-D-フラノシル]-β-D-グルコピラノシド
  • 3,4,5-トリメトキシフェニル6-O-[5-O-(3,4-ジヒドロキシシンナモイル)-D-アピオ-β-D-フラノシル]-β-D-グルコピラノシド
  • [(3S,4R,5R)-3,4-ジヒドロキシ-5-{[(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-(3,4,5-トリメトキシフェノキシ)オキサン-2-イル]メトキシ}オキソラン-3-イル]メチル (2E)-3-(3,4-ジヒドロキシフェニル)プロパ-2-エノアート
  • [(3S,4R,5R)-3,4-dihydroxy-5-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(3,4,5-trimethoxyphenoxy)oxan-2-yl]methoxy}oxolan-3-yl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Other name (4)：
  • ケランパヨシドB
  • Kelampayoside B
  • 3,4,5-Trimethoxyphenyl 6-O-[5-O-[(E)-3-(3,4-dihydroxyphenyl)propenoyl]-D-apio-β-D-furanosyl]-β-D-glucopyranoside
  • 3,4,5-Trimethoxyphenyl 6-O-[5-O-(3,4-dihydroxycinnamoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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