(S)-Ketoprofen Acyl-β-D-glucuronide


CAS No. : 140148-26-1

(S)-Ketoprofen Acyl-β-D-glucuronide,140148-26-1
Product Details
Cat No:R048730
Synonyms:1-[(αS)-3-Benzoyl-α-methylbenzeneacetate]-β-D-glucopyranuronic Αcid; (S)-Ketoprofen Glucuronide;
Molecular Formula:C22H22O9
Molecular Weight:430.409
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Cat No:R048730
Cas No:140148-26-1
Product-Name:(S)-Ketoprofen Acyl-β-D-glucuronide
IUPAC Name:(2S,3S,4S,5R,6S)-6-[(2S)-2-(3-benzoylphenyl)propanoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI:InChI=1S/C22H22O9/c1-11(13-8-5-9-14(10-13)15(23)12-6-3-2-4-7-12)21(29)31-22-18(26)16(24)17(25)19(30-22)20(27)28/h2-11,16-19,22,24-26H,1H3,(H,27,28)/t11-,16-,17-,18+,19-,22-/m0/s1
InChIKey:PBTXSZZKPHBHMA-QVTYPLGRSA-N
SMILES:CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OC3C(C(C(C(O3)C(=O)O)O)O)O
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