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Substrate Report for: Probenecid-glucuronide

Name Class
Probenecid-glucuronideTypeLactone
Drug
Not A/B H target
Glucuronide
Other_NameProbenecid Glucuronide
Probenecid Acyl beta-D-Glucuronide
AC1L4AEK
Probenecid Acyl |A-D-Glucuronide
ZINC31501036
Chemical_Nomenclature(2S,3S,4S,5R,6S)-6-[4-(dipropylsulfamoyl)benzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
FormulaC19H27NO10S
CAS_number34017-15-7
MW461.48
PaperIto_2014_Drug.Metab.Dispos_42_2109
CommentProbenecid, a widely used uricosuric agent, is mainly metabolized to probenecid acyl glucuronide (PRAG), which is considered a causal substance of severe allergic or anaphylactoid reactions
Gene_locushuman-ABHD10
CID182154
FamilyABHD10
InChIKeyBZOGRYWIYJNLDE-NAHJCDBISA-N
CanonicalSMILESCCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O
InChIInChI=1S/C19H27NO10S/c1-3-9-20(10-4-2)31(27,28)12-7-5-11(6-8-12)18(26)30-19-15(23)13(21)14(22)16(29-19)17(24)25/h5-8,13-16,19,21-23H,3-4,9-10H2,1-2H3,(H,24,25)/t13-,14-,15+,16-,19-/m0/s1

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Mail to: Nicolas Lenfant, Thierry Hotelier, Yves Bourne, Pascale Marchot and Arnaud Chatonnet.
Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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