Clenbuterol O-glucuronide potassium salt
Product Code
TRC-C912310-50MG
Product Format
Neat
Molecular Formula
C18H25Cl2KN2O7
Molecular Weight
491.4
Product Categories
Alternate CAS Number
Product Information
Chemical Data
Analyte Name
Clenbuterol O-glucuronide potassium salt
Molecular Formula
C18H25Cl2KN2O7
Molecular Weight
491.4
Accurate Mass
490.07
SMILES
O=C(O[K])[C@H]([C@H]([C@@H]([C@H]1O)O)O)O[C@H]1OC(C2=CC(Cl)=C(C(Cl)=C2)N)CNC(C)(C)C
InChI
InChI=1S/C18H26Cl2N2O7.K/c1-18(2,3)22-6-10(7-4-8(19)11(21)9(20)5-7)28-17-14(25)12(23)13(24)15(29-17)16(26)27;/h4-5,10,12-15,17,22-25H,6,21H2,1-3H3,(H,26,27);/q;+1/p-1/t10?,12-,13-,14+,15-,17+;/m0./s1
IUPAC
potassium (2S,3S,4S,5R,6R)-6-(1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate
Alternate CAS Number
Free acid: 1428441-54-6
Product Data
Country of Origin
CANADA
Product Format
Neat
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