Chem
J-GLOBAL ID：200907062943971159   Nikkaji number：J410.465J

Calceolarioside A

カルセオラリオシドA
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： C23H26O11
Molecular formula furigana： C23-H26-O11
Molecular weight： 478.450
InChI： InChI=1S/C23H26O11/c24-11-18-22(34-19(29)6-3-12-1-4-14(25)16(27)9-12)20(30)21(31)23(33-18)32-8-7-13-2-5-15(26)17(28)10-13/h1-6,9-10,18,20-28,30-31H,7-8,11H2/b6-3+/t18-,20-,21-,22-,23-/m1/s1
InChI key： UHIGZYLCYRQESL-VJWFJHQPSA-N
SMILES： OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1OC(=O)/C=C/c1ccc(O)c(O)c1
Systematic name  (3)：
  • 2-(3,4-ジヒドロキシフェニル)エチル4-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
  • (2R,3S,4R,5R,6R)-6-[2-(3,4-ジヒドロキシフェニル)エトキシ]-4,5-ジヒドロキシ-2-(ヒドロキシメチル)オキサン-3-イル (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,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Other name (5)：
  • デスラムノシルアクテオシド
  • Desrhamnosyl acteoside
  • 2-(3,4-Dihydroxyphenyl)ethyl 4-O-[(E)-3-(3,4-dihydroxyphenyl)propenoyl]-β-D-glucopyranoside
  • カルセオラリオシドA
  • Calceolarioside A
CAS registry number： 84744-28-5
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