dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)

C219H330F17Li2N21O57 — CID 160816864

IUPACdilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)
SMILESCC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)[O-])C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)[O-])C1.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](N)C(C)C.COC(=O)C1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@@]1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@]1(F)CCN(Cc2ccccc2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[Li+].[Li+]
InChIInChI=1S/2C40H63FN4O8.C34H56N4O7.3C13H16FNO2.2C11H18FNO4.4C10H16FNO4.2C2HF3O2.2Li/c2*1-10-26(4)35(44(6)38(49)29(25(2)3)22-33(46)40(41)18-19-42-24-40)32(51-7)23-34(47)45-20-14-17-31(45)36(52-8)27(5)37(48)43-30(39(50)53-9)21-28-15-12-11-13-16-28;1-10-22(4)30(37(6)33(41)29(35)21(2)3)27(43-7)20-28(39)38-18-14-17-26(38)31(44-8)23(5)32(40)36-25(34(42)45-9)19-24-15-12-11-13-16-24;3*1-17-12(16)13(14)7-8-15(10-13)9-11-5-3-2-4-6-11;2*1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4;4*1-9(2,3)16-8(15)12-5-4-10(11,6-12)7(13)14;2*3-2(4,5)1(6)7;;/h2*11-13,15-16,25-27,29-32,35-36,42H,10,14,17-24H2,1-9H3,(H,43,48);11-13,15-16,21-23,25-27,29-31H,10,14,17-20,35H2,1-9H3,(H,36,40);3*2-6H,7-10H2,1H3;2*5-7H2,1-4H3;4*4-6H2,1-3H3,(H,13,14);2*(H,6,7);;/q;;;;;;;;;;;;;;2*+1/p-2/t26-,27+,29-,30-,31-,32+,35-,36+,40+;26-,27+,29-,30-,31-,32+,35-,36+,40-;22-,23+,25-,26-,27+,29-,30-,31+;2*13-;;2*11-;4*10-;;;;/m00010.101100..../s1
InChIKeyXTZSCLICNVQOMC-ZEZZAADFSA-L
MW4505.99 g/mol
LogP16.89
Rot. Bonds72

About dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)

dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) (PubChem CID 160816864) has the molecular formula C219H330F17Li2N21O57 and a molecular weight of 4505.99 g/mol. Its IUPAC name is dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid).

Molecular Properties

Compound Namedilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)
PubChem CID160816864
Molecular FormulaC219H330F17Li2N21O57
Molecular Weight4505.99 g/mol
Exact Mass4503.36
IUPAC Namedilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)
SMILESCC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)[O-])C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)[O-])C1.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](N)C(C)C.COC(=O)C1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@@]1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@]1(F)CCN(Cc2ccccc2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[Li+].[Li+]
InChIInChI=1S/2C40H63FN4O8.C34H56N4O7.3C13H16FNO2.2C11H18FNO4.4C10H16FNO4.2C2HF3O2.2Li/c2*1-10-26(4)35(44(6)38(49)29(25(2)3)22-33(46)40(41)18-19-42-24-40)32(51-7)23-34(47)45-20-14-17-31(45)36(52-8)27(5)37(48)43-30(39(50)53-9)21-28-15-12-11-13-16-28;1-10-22(4)30(37(6)33(41)29(35)21(2)3)27(43-7)20-28(39)38-18-14-17-26(38)31(44-8)23(5)32(40)36-25(34(42)45-9)19-24-15-12-11-13-16-24;3*1-17-12(16)13(14)7-8-15(10-13)9-11-5-3-2-4-6-11;2*1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4;4*1-9(2,3)16-8(15)12-5-4-10(11,6-12)7(13)14;2*3-2(4,5)1(6)7;;/h2*11-13,15-16,25-27,29-32,35-36,42H,10,14,17-24H2,1-9H3,(H,43,48);11-13,15-16,21-23,25-27,29-31H,10,14,17-20,35H2,1-9H3,(H,36,40);3*2-6H,7-10H2,1H3;2*5-7H2,1-4H3;4*4-6H2,1-3H3,(H,13,14);2*(H,6,7);;/q;;;;;;;;;;;;;;2*+1/p-2/t26-,27+,29-,30-,31-,32+,35-,36+,40+;26-,27+,29-,30-,31-,32+,35-,36+,40-;22-,23+,25-,26-,27+,29-,30-,31+;2*13-;;2*11-;4*10-;;;;/m00010.101100..../s1
InChIKeyXTZSCLICNVQOMC-ZEZZAADFSA-L
XLogP16.89
TPSA975.58 Ų
H-Bond Donors10
H-Bond Acceptors59
Rotatable Bonds72
Heavy Atoms316
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004505.99
LogP ≤ 516.89
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1059

Analyze dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) with MolForge

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What is the IUPAC name of dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)?
The IUPAC name of dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) (CID 160816864) is dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid).
What is the SMILES notation for dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)?
The canonical SMILES for dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) is CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)[O-])C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)O)C1.CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)[O-])C1.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](CC(=O)[C@]1(F)CCNC1)C(C)C.CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](N)C(C)C.COC(=O)C1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@@]1(F)CCN(Cc2ccccc2)C1.COC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1.COC(=O)[C@]1(F)CCN(Cc2ccccc2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[Li+].[Li+].
What is the InChIKey of dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)?
The InChIKey is XTZSCLICNVQOMC-ZEZZAADFSA-L. The full InChI is InChI=1S/2C40H63FN4O8.C34H56N4O7.3C13H16FNO2.2C11H18FNO4.4C10H16FNO4.2C2HF3O2.2Li/c2*1-10-26(4)35(44(6)38(49)29(25(2)3)22-33(46)40(41)18-19-42-24-40)32(51-7)23-34(47)45-20-14-17-31(45)36(52-8)27(5)37(48)43-30(39(50)53-9)21-28-15-12-11-13-16-28;1-10-22(4)30(37(6)33(41)29(35)21(2)3)27(43-7)20-28(39)38-18-14-17-26(38)31(44-8)23(5)32(40)36-25(34(42)45-9)19-24-15-12-11-13-16-24;3*1-17-12(16)13(14)7-8-15(10-13)9-11-5-3-2-4-6-11;2*1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4;4*1-9(2,3)16-8(15)12-5-4-10(11,6-12)7(13)14;2*3-2(4,5)1(6)7;;/h2*11-13,15-16,25-27,29-32,35-36,42H,10,14,17-24H2,1-9H3,(H,43,48);11-13,15-16,21-23,25-27,29-31H,10,14,17-20,35H2,1-9H3,(H,36,40);3*2-6H,7-10H2,1H3;2*5-7H2,1-4H3;4*4-6H2,1-3H3,(H,13,14);2*(H,6,7);;/q;;;;;;;;;;;;;;2*+1/p-2/t26-,27+,29-,30-,31-,32+,35-,36+,40+;26-,27+,29-,30-,31-,32+,35-,36+,40-;22-,23+,25-,26-,27+,29-,30-,31+;2*13-;;2*11-;4*10-;;;;/m00010.101100..../s1.
What are the key properties of dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid)?
dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) has a molecular weight of 4505.99 g/mol, XLogP of 16.89, 72 rotatable bonds, 10 hydrogen bond donors, and 59 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;1-O-tert-butyl 3-O-methyl (3S)-3-fluoropyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3R)-3-fluoropyrrolidine-1,3-dicarboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylate;(3S)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;(3R)-3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-amino-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl 1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3S)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (3R)-1-benzyl-3-fluoropyrrolidine-3-carboxylate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3S)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;methyl (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-4-[(3R)-3-fluoropyrrolidin-3-yl]-4-oxo-2-propan-2-ylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoate;bis(2,2,2-trifluoroacetic acid) is sourced from PubChem (CID 160816864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).