Chem
J-GLOBAL ID：200907071626538643   Nikkaji number：J410.462E

Robutaside B

ロブスタシド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： C21H22O10
Molecular formula furigana： C21-H22-O10
Molecular weight： 434.397
InChI： InChI=1S/C21H22O10/c22-12-3-5-13(6-4-12)30-21-20(28)19(27)18(26)16(31-21)10-29-17(25)8-2-11-1-7-14(23)15(24)9-11/h1-9,16,18-24,26-28H,10H2/b8-2+/t16-,18-,19+,20-,21-/m1/s1
InChI key： OONDLKCAZJZRCW-CTPWMPFQSA-N
SMILES： O[C@@H]1[C@@H](COC(=O)/C=C/c2ccc(O)c(O)c2)O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@H]1O
Systematic name  (5)：
  • 4-ヒドロキシフェニル6-O-[(E)-3-(3,4-ジヒドロキシフェニル)プロペノイル]-β-D-グルコピラノシド
  • 4-[[6-O-(3,4-ジヒドロキシ-trans-シンナモイル)-β-D-グルコピラノシル]オキシ]フェノール
  • 4-ヒドロキシフェニル6-O-[(E)-3-(3,4-ジヒドロキシフェニル)-1-オキソ-2-プロペニル]-β-D-グルコピラノシド
  • [(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-(4-ヒドロキシフェノキシ)オキサン-2-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
  • [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Other name (5)：
  • 4-Hydroxyphenyl 6-O-[(E)-3-(3,4-dihydroxyphenyl)propenoyl]-β-D-glucopyranoside
  • 4-[[6-O-(3,4-Dihydroxy-trans-cinnamoyl)-β-D-glucopyranosyl]oxy]phenol
  • ロブスタシドB
  • Robutaside B
  • 4-Hydroxyphenyl 6-O-[(E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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