rel-(1R,3S,4R,5S)-1-Hydroxy-3,4,5-tris((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid

Catalog No. :
ACCUAP306
CAS No. :
99745-62-7
Molecular Formula :
C28H24O18
Molecular Weight :
648.48

IUPAC Name:(1R,3S,4R,5S)-1-hydroxy-3,4,5-tris((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid

rel-(1R,3S,4R,5S)-1-Hydroxy-3,4,5-tris((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid structure diagram
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Product Information

Product Namerel-(1R,3S,4R,5S)-1-Hydroxy-3,4,5-tris((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid
IUPAC Name(1R,3S,4R,5S)-1-hydroxy-3,4,5-tris((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid
Molecular FormulaC28H24O18
Molecular Weight648.48
SMILESO=C(O[C@H]1C[C@](O)(C(=O)O)C[C@H](OC(=O)C2=CC(O)=C(O)C(O)=C2)[C@H]1OC(=O)C1=CC(O)=C(O)C(O)=C1)C1=CC(O)=C(O)C(O)=C1
InChI KeyPEOHIPMSHPWYAQ-USOBFKSOSA-N
Synonym3,4,5-tri-O-galloylquinic acid;3,4,5-TRI-ORTHO-GALLOYLQUINICACID;Benzoic acid, 3,4,5-trihydroxy-, (1R,2α,3R,5α)-5-carboxy-5-hydroxy-1,2,3-cyclohexanetriyl ester, rel-
CAS No.99745-62-7

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319
Precautionary Statement(s)
P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501

Synthetic Route by SureRoute

1. ACCUAP306 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACCUAP306 route product structure diagram
    ACCUAP30699745-62-7
Inquiry

2. ACCUAP306 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACCUAP306 route product structure diagram
    ACCUAP30699745-62-7
Inquiry

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