0 B32R5.316094869 CC[C@@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)OC)O MCULE-4714932232 [0,0,0,0,0,0|0,0,0]=0 1 B32R5.316094869 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)OC)O MCULE-3689606232 [0,0,0,0,0,0|0,0,0]=0 2 B32R5.316094869 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)OC)O MCULE-4196456030 [0,0,0,0,0,0|0,0,0]=0 3 B31R5.1290800461 CCC1(C(=O)OCC2=C1C=C3C4=NC5=C(C=C4CN3C2=O)C(=CC=C5)N)O MCULE-5068840824 [1,0,0,0,0,0|1,0,0]=2 4 B31R5.1290800461 CCC1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)O)O MCULE-6520158796 [1,0,0,0,0,0|0,0,0]=1 5 B31R5.1290800461 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)N)O MCULE-7175414234 [1,0,0,0,0,0|1,0,0]=2 6 B31R5.1290800461 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)N)O MCULE-9765473112 [1,0,0,0,0,0|1,0,0]=2 7 B31R5.1290800461 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)O)O MCULE-4466194725 [1,0,0,0,0,0|0,0,0]=1 8 B31R5.1290800461 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)O)O MCULE-4532390374 [1,0,0,0,0,0|0,0,0]=1 9 B33R5.2934314967 CCC1(C(=O)OCC2=C1C=C3C4=NC5=C(C=C4CN3C2=O)C(=CC=C5)N(=O)=O)O MCULE-6016380197 [0,1,0,0,0,0|2,0,0]=3 10 B33R5.2934314967 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=C(C=C4CN3C2=O)C(=CC=C5)[N+](=O)[O-])O MCULE-6404718274 [0,1,0,0,0,0|2,0,0]=3 11 B33R5.2934314967 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=CC(=C5C=C4CN3C2=O)[N+](=O)[O-])O MCULE-1551776158 [0,1,0,0,0,0|2,0,0]=3 12 B30R5.946948000 CCC1(C(=O)OCC2=C1C=C3C4=NC5=C(C=CC=C5)C=C4CN3C2=O)O MCULE-8069978843 [2,0,0,0,0,0|0,0,0]=2 13 B30R5.946948000 CC[C@]1(C(=O)OCC2=C1C=C3C4=C(C=C5C=CC=CC5=N4)CN3C2=O)[O-] MCULE-7069029673 [2,0,0,0,0,0|0,0,1]=3 14 B30R5.946948000 CC[C@]1(C(=O)OCC2=C1C=C3C4=C(C=C5C=CC=CC5=N4)CN3C2=O)[O-] MCULE-9229254747 [2,0,0,0,0,0|0,0,1]=3 15 B30R5.946948000 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=C(C=CC=C5)C=C4CN3C2=O)O MCULE-1654983682 [2,0,0,0,0,0|0,0,0]=2 16 B30R5.946948000 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=C(C=CC=C5)C=C4CN3C2=O)O MCULE-7286604863 [2,0,0,0,0,0|0,0,0]=2 17 B34R5.594259105 C=CCC1=C(C=CC2=C1C=C3CN4C(=O)C5=C(C=C4C3=N2)[C@@](C(=O)OC5)(O)CC)O MCULE-6424777639 [0,2,0,0,0,0|1,0,1]=4 18 B34R5.594259105 C=CCC1=C(C=CC2=C1C=C3CN4C(=O)C5=C(C=C4C3=N2)[C@@](C(=O)OC5)(O)CC)O MCULE-9440826024 [0,2,0,0,0,0|1,0,1]=4 19 B32R5.780624212 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=C(C=C5C=C4CN3C2=O)OC)O MCULE-1719617479 [0,0,0,0,1,1|0,0,0]=2 20 B32R5.780624212 CC[C@]1(C(=O)OCC2=C1C=C3C4=NC5=CC=C(C=C5C=C4CN3C2=O)OC)O MCULE-6293315319 [0,0,0,0,1,1|0,0,0]=2