Molecule: salicylic acyl beta-D-glucuronide (1-)
metabolite of salicylate
Synonyms for salicylic acyl beta-D-glucuronide (1-) :
Molecular Formula: C13H13O9
Molecular wt: 313.239 g/mole
Charge: -1
SMILES: [C@@H]1(OC(=O)C=2C(=CC=CC2)O)O[C@H](C([O-])=O)[C@H]([C@@H]([C@H]1O)O)O
InChIKey: IXVVXKRKCLJCKA-UNLLLRGISA-M
InChI=1S/C13H14O9/c14-6-4-2-1-3-5(6)12(20)22-13-9(17)7(15)8(16)10(21-13)11(18)19/h1-4,7-10,13-17H,(H,18,19)/p-1/t7-,8-,9+,10-,13-/m0/s1
Sample reactions for this molecule: