Chem
J-GLOBAL ID：200907067012720502   Nikkaji number：J797.634H

Conandroside

コナンドロシド
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： C28H34O15
Molecular formula furigana： C28-H34-O15
Molecular weight： 610.565
InChI： InChI=1S/C28H34O15/c29-11-20-25(42-21(35)6-3-13-1-4-15(30)17(32)9-13)26(43-27-23(37)22(36)19(34)12-40-27)24(38)28(41-20)39-8-7-14-2-5-16(31)18(33)10-14/h1-6,9-10,19-20,22-34,36-38H,7-8,11-12H2/t19-,20-,22+,23-,24-,25-,26-,27+,28-/m1/s1
InChI key： IIVINXPOHZUXQM-VFHDLKEOSA-N
SMILES： OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1OC(=O)C=Cc1ccc(O)c(O)c1
Systematic name  (4)：
  • 1-O-(3,4-ジヒドロキシフェネチル)-3-O-β-D-キシロピラノシル-4-O-[3-(3,4-ジヒドロキシフェニル)アクリロイル]-β-D-グルコピラノース
  • 3,4-ジヒドロキシフェネチル4-O-[3-(3,4-ジヒドロキシフェニル)プロペノイル]-3-O-β-D-キシロピラノシル-β-D-グルコピラノシド
  • (2R,3R,4R,5R,6R)-6-[2-(3,4-ジヒドロキシフェニル)エトキシ]-5-ヒドロキシ-2-(ヒドロキシメチル)-4-{[(2S,3R,4S,5R)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}オキサン-3-イル 3-(3,4-ジヒドロキシフェニル)プロパ-2-エノアート
  • (2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate
Other name (4)：
  • コナンドロシド
  • Conandroside
  • 1-O-(3,4-Dihydroxyphenethyl)-3-O-β-D-xylopyranosyl-4-O-[3-(3,4-dihydroxyphenyl)acryloyl]-β-D-glucopyranose
  • 3,4-Dihydroxyphenethyl 4-O-[3-(3,4-dihydroxyphenyl)propenoyl]-3-O-β-D-xylopyranosyl-β-D-glucopyranoside
CAS registry number： 64142-04-7
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