(2S,3S,4S,5R,6S)-6-((3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

Catalog No. :
ACWFRJ169
CAS No. :
102623-14-3
Molecular Formula :
C23H28N2O11S
Molecular Weight :
540.55

IUPAC Name:(2S,3S,4S,5R,6S)-6-((3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

(2S,3S,4S,5R,6S)-6-((3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid structure diagram
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Product Information

Product Name(2S,3S,4S,5R,6S)-6-((3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
IUPAC Name(2S,3S,4S,5R,6S)-6-((3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
Molecular FormulaC23H28N2O11S
Molecular Weight540.55
SMILESCCCCNC1=C(OC2=CC=CC=C2)C(S(N)(=O)=O)=CC(C(=O)O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)=C1
InChI KeyMXEVQINQQGRZRQ-RZUKHUMYSA-N
SynonymBumetanide glucuronide;1-[3-(Aminosulfonyl)-5-(butylamino)-4-phenoxybenzoate] beta-D-glucopyranuronic acid;Bumetanide β-D-Glucuronide;Bumetanide Impurity 5 (Bumetanide β-D-Glucuronide);Bumetanide β-D-Glucuronides;β-D-Glucopyranuronic acid, 1-[3-(aminosulfonyl)-5-(butylamino)-4-phenoxybenzoate];(2S,3S,4S,5R,6S)-6-((3-(Butylamino)-4-phenoxy-5-sulfamoylbenzoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid (Bumetanide Impurity)
CAS No.102623-14-3

Synthetic Route by SureRoute

1. ACWFRJ169 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACWFRJ169 route product structure diagram
    ACWFRJ169102623-14-3
Inquiry

2. ACWFRJ169 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACWFRJ169 route product structure diagram
    ACWFRJ169102623-14-3
Inquiry

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