Compound ID,Canonical SMILES,Formula,Normalized Calcium Leak
1,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H76N4O12,0.36 ± 0.38*
8,O=C([H])CCCCC,C6H12O,
9,O[C@H](C[N+]([O-])=O)CCCCC,C7H15NO3,
10,CCCCC[C@H](OCOC)C[N+]([O-])=O,C9H19NO4,
11,OC([C@@H](OCOC)CCCCC)=O,C9H18O4,
12,O=C(OCC1=CC=CC=C1)[C@@H](OCOC)CCCCC,C16H24O4,
M13,O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O,C14H20O3,
14,[H]N(C(OC(C)(C)C)=O)C(S(C1=CC=C(C)C=C1)(=O)=O)CCCCC,C18H29NO4S,
15,[H]/C(CCCCC)=N\C(OC(C)(C)C)=O,C11H21NO2,
16,BrC([N+]([O-])=O)[C@@H](N(C(OC(C)(C)C)=O)[H])CCCCC,C12H23BrN2O4,
17,[H]N(C(OC(C)(C)C)=O)[C@H](C[N+]([O-])=O)CCCCC,C12H24N2O4,
18,OC([C@H](CCCCC)N([H])C(OC(C)(C)C)=O)=O,C12H23NO4,
19,O=C(OCC1=CC=CC=C1)[C@@H](N([H])C(OC(C)(C)C)=O)CCCCC,C19H29NO4,
M20,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N([H])[H],C14H21NO2,
21,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)C(OC(C)(C)C)=O,C20H31NO4,
M22,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)[H],C15H23NO4,
23,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)OC([C@@H](C)N([H])C(OC(C)(C)C)=O)=O,C22H33NO6,
D24,OC([C@H](CCCCC)OC([C@@H](C)N([H])C(OC(C)(C)C)=O)=O)=O,C15H27NO6,
D25,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)OC([C@@H](C)N([H])[H])=O,C17H25NO4,
26,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)OC([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C23H35NO6,
D27,OC([C@H](CCCCC)OC([C@@H](C)N(C)C(OC(C)(C)C)=O)=O)=O,C16H29NO6,
D28,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)OC([C@@H](C)N(C)[H])=O,C18H27NO4,
29,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)C([C@@H](C)N([H])C(OC(C)(C)C)=O)=O,C23H36N2O5,
D30,OC([C@H](CCCCC)N(C)C([C@@H](C)N([H])C(OC(C)(C)C)=O)=O)=O,C16H30N2O5,
D31,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)C([C@@H](C)N([H])[H])=O,C18H28N2O3,
32,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N([H])C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C23H36N2O5,
D33,OC([C@H](CCCCC)N([H])C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O)=O,C16H30N2O5,
D34,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N([H])C([C@@H](C)N(C)[H])=O,C18H28N2O3,
35,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C24H38N2O5,
D36,OC([C@H](CCCCC)N(C)C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O)=O,C17H32N2O5,
D37,O=C(OCC1=CC=CC=C1)[C@H](CCCCC)N(C)C([C@@H](C)N(C)[H])=O,C19H30N2O3,
T38,O=C(N([H])[C@H](C)C(O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)OC([C@@H](C)N([H])C(OC(C)(C)C)=O)=O,C32H50N2O9,
T39,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C34H54N2O9,
T40,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N([H])C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C34H55N3O8,
T41,O=C(N(C)[C@H](C)C(N(C)[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C35H57N3O8,
T42,O=C(N(C)[C@H](C)C(N(C)[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N(C)C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C36H60N4O7,
T43,O=C(N([H])[C@H](C)C(N(C)[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N(C)C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C35H58N4O7,
T44,O=C(N([H])[C@H](C)C(N(C)[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N(C)C([C@@H](C)N([H])C(OC(C)(C)C)=O)=O,C34H56N4O7,
T45,O=C(N(C)[C@H](C)C(N(C)[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N(C)C([C@@H](C)N([H])C(OC(C)(C)C)=O)=O,C35H58N4O7,
T46,O=C(N(C)[C@H](C)C(N([H])[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N([H])C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C34H56N4O7,
T47,O=C(N(C)[C@H](C)C(N([H])[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)[C@H](CCCCC)N(C)C([C@@H](C)N(C)C(OC(C)(C)C)=O)=O,C35H58N4O7,
H48,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C(OC(C)(C)C)=O)C)=O,C45H73N3O12,
O49,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)[H])C)=O)=O)C)=O,C55H90N4O15,
O50,O=C([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)=O,C54H88N4O15,
H51,[H]N(C(OC(C)(C)C)=O)[C@H](C)CO[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)=O,C42H69N3O11,
O52,O=C([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)[H])O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)=O,C53H86N4O15,
O53,O=C([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)[H])C)=O)=O)[H])O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@@H](CCCCC)C(N([H])[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)=O,C52H84N4O15,
O54,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C(OC(C)(C)C)=O)C)=O,C56H93N5O14,
O55,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)=O)=O)[C@H](CCCCC)NC([C@@H](C)N(C([C@H](CCCCC)NC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O,C56H94N6O13,
O56,O=C(N(C)[C@H](C)C(N[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(OCC1=CC=CC=C1)=O)=O)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C([C@H](CCCCC)NC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O,C56H94N6O13,
H57,O=C(N(C)[C@H](C)C(N[C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)NC([C@@H](C)N(C(OC(C)(C)C)=O)C)=O,C45H76N6O9,
O58,O=C(N(C)[C@H](C)C(N[C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)NC([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O,C56H95N7O12,
O59,O=C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)[C@H](CCCCC)NC([C@H](N(C([C@H](CCCCC)NC[C@@H](C)N(C([C@H](CCCCC)NC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O)C)C)=O,C56H98N8O10,
O60,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)OC([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O,C57H95N5O14,
O61,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)OC([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O,C58H98N6O13,
O62,O=C(N(C)[C@H](C)C(O[C@@H](CCCCC)C(N(C)[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)OC([C@H](N(C(OC(C)(C)C)=O)C)C)=O)=O)C)=O)C,C58H98N6O13,
H63,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C41H76N6O9,
O64,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(O[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C59H101N7O12,
O65,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C60H104N8O11,
O66,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)[H])C)=O)C)=O)C)=O)C,C59H102N8O11,
O67,O=C(N([H])[C@H](C)C(N([C@@H](CCCCC)C(N([H])[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C58H100N8O11,
O68,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N([H])[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)[H])=O)C,C58H100N8O11,
O69,O=C(N([H])[C@H](C)C(N([C@@H](CCCCC)C(N([H])[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)[H])=O)C,C57H98N8O11,
O70,O=C(N([H])[C@H](C)C(N([C@@H](CCCCC)C(N([H])[C@H](C)C(N([C@H](C(OCC1=CC=CC=C1)=O)CCCCC)C)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)[H])C)=O)C)=O)[H])=O)C,C56H96N8O11,
O71,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)C)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C59H102N8O11,
O72,O=C(N(C)[C@H](C)C(N[C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)N(C([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O)C,C58H100N8O11,
O73,O=C(N(C)[C@H](C)C(N([C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)C)=O)[C@H](CCCCC)NC([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O,C58H100N8O11,
O74,O=C(N(C)[C@H](C)C(N[C@@H](CCCCC)C(N(C)[C@H](C)C(N[C@H](C(OCC1=CC=CC=C1)=O)CCCCC)=O)=O)=O)[C@H](CCCCC)NC([C@@H](C)N(C([C@H](CCCCC)N(C([C@H](N(C(OC(C)(C)C)=O)C)C)=O)C)=O)C)=O,C57H98N8O11,
1.1,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](NC1=O)C)CCCCC)C)C)CCCCC,C43H74N4O12,1.02 ± 0.71
1.2,CCCCC[C@@H]1OC(=O)[C@@H](C)NC(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](NC1=O)C)CCCCC)C)C)CCCCC,C42H72N4O12,0.91 ± 0.63
1.3,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)NC(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](NC1=O)C)CCCCC)C)C)CCCCC,C42H72N4O12,0.90 ± 0.60
1.4,CCCCC[C@@H]1OC(=O)[C@@H](C)NC(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](NC(=O)[C@@H](OC(=O)[C@H](NC1=O)C)CCCCC)C)CCCCC,C41H70N4O12,0.77 ± 0.53
1.5,CCCCC[C@@H]1OC(=O)[C@@H](C)NC(=O)[C@H](CCCCC)OC(=O)[C@@H](C)NC(=O)[C@@H](OC(=O)[C@H](NC(=O)[C@@H](OC(=O)[C@H](NC1=O)C)CCCCC)C)CCCCC,C40H68N4O12,0.91 ± 0.46
2.1,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H77N5O11,0.60 ± 0.65
2.2,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H78N6O10,0.79 ± 0.44
2.3,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H78N6O10,1.03 ± 0.53
2.4,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H79N7O9,0.97 ± 0.56
2.5,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)CCCCC,C44H80N8O8,1.09 ± 0.46
3.1,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)OC(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)C)CCCCC,C45H79N5O11,0.75 ± 0.63
3.2,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](OC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)C)CCCCC,C46H82N6O10,0.99 ± 0.53
3.3,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](OC(=O)[C@H](N(C(=O)[C@@H](N(C(=O)[C@H](N(C1=O)C)C)C)CCCCC)C)C)CCCCC,C46H82N6O10,0.93 ± 0.45
3.4,CCCCC[C@@H]1OC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](N(C(=O)[C@H](N(C1=O)C)C)C)CCCCC)C)C)C)CCCCC,C47H85N7O9,1.20 ± 0.63
3.5,CCCCC[C@H]1C(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](C(=O)N([C@@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N1C)C)C)CCCCC)C)C)C)CCCCC,C48H88N8O8,1.04 ± 0.71
4.2,CCCCC[C@H]1C(=O)N[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](C(=O)N([C@@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N1C)C)C)CCCCC)C)C)C)CCCCC,C47H86N8O8,1.35 ± 1.14
4.3,CCCCC[C@H]1C(=O)N[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](C(=O)N([C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N1C)C)CCCCC)C)C)C)CCCCC,C46H84N8O8,1.79 ± 1.49
4.4,CCCCC[C@H]1C(=O)N[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N1C)C)C)CCCCC)C)C)CCCCC,C46H84N8O8,1.38 ± 1.21
4.5,CCCCC[C@H]1C(=O)N[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N[C@H](C)C(=O)N(C)[C@H](C(=O)N([C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N1C)C)CCCCC)C)C)C)CCCCC,C45H82N8O8,1.43 ± 0.66
4.6,CCCCC[C@H]1C(=O)N[C@H](C)C(=O)N(C)[C@@H](CCCCC)C(=O)N[C@H](C)C(=O)N(C)[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N1C)C)CCCCC)C)C)CCCCC,C44H80N8O8,1.15 ± 0.71
5.2,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](N(C(=O)[C@H](N(C1=O)C)C)C)CCCCC)C)C)C)CCCCC,C47H86N8O8,1.08 ± 0.66
5.3,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)C)CCCCC,C46H84N8O8,1.23 ± 0.57
5.4,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](N(C(=O)[C@H](N(C1=O)C)C)C)CCCCC)C)C)CCCCC,C46H84N8O8,1.14 ± 0.69
5.5,CCCCC[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H](CCCCC)NC(=O)[C@@H](C)N(C)C(=O)[C@@H](N(C(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@H](N(C1=O)C)C)CCCCC)C)C)C)CCCCC,C45H82N8O8,1.14 ± 0.65