3,7,8-Tri-O-methylellagic acid 2-O-rutinoside

Catalog No. :
ACJZZT173
CAS No. :
56470-18-9
Molecular Formula :
C29H32O17
Molecular Weight :
652.56

IUPAC Name:2,3,8-trimethoxy-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)chromeno[5,4,3-cde]chromene-5,10-dione

3,7,8-Tri-O-methylellagic acid 2-O-rutinoside structure diagram
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Product Information

Product Name3,7,8-Tri-O-methylellagic acid 2-O-rutinoside
IUPAC Name2,3,8-trimethoxy-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)chromeno[5,4,3-cde]chromene-5,10-dione
Molecular FormulaC29H32O17
Molecular Weight652.56
SMILESO(C)C=1C2=C3C4=C(C(OC)=C(OC)C=C4C(=O)O2)OC(=O)C3=CC1O[C@@H]5O[C@H](CO[C@H]6[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O6)[C@@H](O)[C@H](O)[C@H]5O
InChI KeyOTHVXIIXNQEQPH-PICHOHMMSA-N
Synonym3,7,8-Tri-O-methylellagic acid 2-O-rutinoside;[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3,7,8-trimethoxy-;3,3',4'-Tri-O-methylellagic acid 4-O-rutinoside
CAS No.56470-18-9

Synthetic Route by SureRoute

1. ACJZZT173 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACJZZT173 route product structure diagram
    ACJZZT17356470-18-9
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2. ACJZZT173 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACJZZT173 route product structure diagram
    ACJZZT17356470-18-9
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