0  B29R3.16184885462  CCCC1=C2OC(=CC(=O)C2=CC3=C1N(C(=CC3=O)C(=O)O)CC)C(=O)O MCULE-2962455919 [0,0,0,0,0,0|0,0,0]=0
1  B29R3.16184885462  CCCC1=C2OC(=CC(=O)C2=CC3=C1N(C(=CC3=O)C(=O)[O-])CC)C(=O)[O-] MCULE-1130735547 [0,0,0,0,0,0|0,0,2]=2
2  B27R3.2480589446  CCCC1=C2OC(=CC(=O)C2=CC3=C1OC(=CC3=O)C(=O)O)C(=O)O MCULE-5365620140 [2,0,0,0,0,0|1,0,0]=3