Diclofenac Acyl-β-D-glucuronide Allyl Ester

CAS : 698358-10-0

Ref. TR-D436485

Informations sur le produit

• Nom: Diclofenac Acyl-β-D-glucuronide Allyl Ester
• Synonymes: prop-2-enyl (2S,3S,4S,5R,6S)-6-[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
• Marque: TRC
• Description: Applications An intermediate for the synthesis of Diclofenac’s glucuronide metaoblite. Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the packageReferences Kenny, J.R., et al.: J. Med. Chem., 47, 2816 (2004),

Propriétés chimiques

• Masse moléculaire: 512.34
• Formule: C₂₃H₂₃Cl₂NO₈
• Couleur/Forme: Neat
• InChI: InChI=1S/C23H23Cl2NO8/c1-2-10-32-22(31)21-19(29)18(28)20(30)23(34-21)33-16(27)11-12-6-3-4-9-15(12)26-17-13(24)7-5-8-14(17)25/h2-9,18-21,23,26,28-30H,1,10-11H2/t18-,19-,20+,21-,23+/m0/s1
• Code InChI: InChIKey=WNQJKISLWOVAQH-KHYDEXNFSA-N
• SMILES: C=CCOC(=O)[C@H]1O[C@@H](OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)[C@H](O)[C@@H](O)[C@@H]1O