(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid

C157H179F3N12O23 — CID 158103092

IUPAC(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid
SMILESCCCCCCCOc1ccc(-c2cnc(-c3ccc(CC(CC(=O)c4ccc(OC(C)C)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(CCCC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC(F)(F)F)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1
InChIInChI=1S/C41H49N3O5.C40H47N3O6.C38H40F3N3O6.C38H43N3O6/c1-4-6-8-9-10-24-49-37-22-20-32(21-23-37)36-27-42-39(43-28-36)34-18-14-31(15-19-34)25-35(40(46)44-29(3)41(47)48)26-38(45)33-16-12-30(13-17-33)11-7-5-2;1-5-6-7-8-9-22-48-35-18-14-30(15-19-35)34-25-41-38(42-26-34)32-12-10-29(11-13-32)23-33(39(45)43-28(4)40(46)47)24-37(44)31-16-20-36(21-17-31)49-27(2)3;1-3-4-5-6-7-20-49-32-16-12-27(13-17-32)31-23-42-35(43-24-31)29-10-8-26(9-11-29)21-30(36(46)44-25(2)37(47)48)22-34(45)28-14-18-33(19-15-28)50-38(39,40)41;1-4-5-6-7-8-21-47-34-19-13-28(14-20-34)32-24-39-36(40-25-32)30-11-9-27(10-12-30)22-31(37(43)41-26(2)38(44)45)23-35(42)29-15-17-33(46-3)18-16-29/h12-23,27-29,35H,4-11,24-26H2,1-3H3,(H,44,46)(H,47,48);10-21,25-28,33H,5-9,22-24H2,1-4H3,(H,43,45)(H,46,47);8-19,23-25,30H,3-7,20-22H2,1-2H3,(H,44,46)(H,47,48);9-20,24-26,31H,4-8,21-23H2,1-3H3,(H,41,43)(H,44,45)/t29-,35-;28-,33?;25-,30-;26-,31-/m1111/s1
InChIKeyFPMSCFQWWKECRI-VEDXJOOVSA-N
MW2659.21 g/mol
LogP31.76
Rot. Bonds75

About (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid

(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid (PubChem CID 158103092) has the molecular formula C157H179F3N12O23 and a molecular weight of 2659.21 g/mol. Its IUPAC name is (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid.

Molecular Properties

Compound Name(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid
PubChem CID158103092
Molecular FormulaC157H179F3N12O23
Molecular Weight2659.21 g/mol
Exact Mass2657.32
IUPAC Name(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid
SMILESCCCCCCCOc1ccc(-c2cnc(-c3ccc(CC(CC(=O)c4ccc(OC(C)C)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(CCCC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC(F)(F)F)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1
InChIInChI=1S/C41H49N3O5.C40H47N3O6.C38H40F3N3O6.C38H43N3O6/c1-4-6-8-9-10-24-49-37-22-20-32(21-23-37)36-27-42-39(43-28-36)34-18-14-31(15-19-34)25-35(40(46)44-29(3)41(47)48)26-38(45)33-16-12-30(13-17-33)11-7-5-2;1-5-6-7-8-9-22-48-35-18-14-30(15-19-35)34-25-41-38(42-26-34)32-12-10-29(11-13-32)23-33(39(45)43-28(4)40(46)47)24-37(44)31-16-20-36(21-17-31)49-27(2)3;1-3-4-5-6-7-20-49-32-16-12-27(13-17-32)31-23-42-35(43-24-31)29-10-8-26(9-11-29)21-30(36(46)44-25(2)37(47)48)22-34(45)28-14-18-33(19-15-28)50-38(39,40)41;1-4-5-6-7-8-21-47-34-19-13-28(14-20-34)32-24-39-36(40-25-32)30-11-9-27(10-12-30)22-31(37(43)41-26(2)38(44)45)23-35(42)29-15-17-33(46-3)18-16-29/h12-23,27-29,35H,4-11,24-26H2,1-3H3,(H,44,46)(H,47,48);10-21,25-28,33H,5-9,22-24H2,1-4H3,(H,43,45)(H,46,47);8-19,23-25,30H,3-7,20-22H2,1-2H3,(H,44,46)(H,47,48);9-20,24-26,31H,4-8,21-23H2,1-3H3,(H,41,43)(H,44,45)/t29-,35-;28-,33?;25-,30-;26-,31-/m1111/s1
InChIKeyFPMSCFQWWKECRI-VEDXJOOVSA-N
XLogP31.76
TPSA501.61 Ų
H-Bond Donors8
H-Bond Acceptors27
Rotatable Bonds75
Heavy Atoms195
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002659.21
LogP ≤ 531.76
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid?
The IUPAC name of (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid (CID 158103092) is (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid.
What is the SMILES notation for (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid?
The canonical SMILES for (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid is CCCCCCCOc1ccc(-c2cnc(-c3ccc(CC(CC(=O)c4ccc(OC(C)C)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(CCCC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC(F)(F)F)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.CCCCCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](CC(=O)c4ccc(OC)cc4)C(=O)N[C@H](C)C(=O)O)cc3)nc2)cc1.
What is the InChIKey of (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid?
The InChIKey is FPMSCFQWWKECRI-VEDXJOOVSA-N. The full InChI is InChI=1S/C41H49N3O5.C40H47N3O6.C38H40F3N3O6.C38H43N3O6/c1-4-6-8-9-10-24-49-37-22-20-32(21-23-37)36-27-42-39(43-28-36)34-18-14-31(15-19-34)25-35(40(46)44-29(3)41(47)48)26-38(45)33-16-12-30(13-17-33)11-7-5-2;1-5-6-7-8-9-22-48-35-18-14-30(15-19-35)34-25-41-38(42-26-34)32-12-10-29(11-13-32)23-33(39(45)43-28(4)40(46)47)24-37(44)31-16-20-36(21-17-31)49-27(2)3;1-3-4-5-6-7-20-49-32-16-12-27(13-17-32)31-23-42-35(43-24-31)29-10-8-26(9-11-29)21-30(36(46)44-25(2)37(47)48)22-34(45)28-14-18-33(19-15-28)50-38(39,40)41;1-4-5-6-7-8-21-47-34-19-13-28(14-20-34)32-24-39-36(40-25-32)30-11-9-27(10-12-30)22-31(37(43)41-26(2)38(44)45)23-35(42)29-15-17-33(46-3)18-16-29/h12-23,27-29,35H,4-11,24-26H2,1-3H3,(H,44,46)(H,47,48);10-21,25-28,33H,5-9,22-24H2,1-4H3,(H,43,45)(H,46,47);8-19,23-25,30H,3-7,20-22H2,1-2H3,(H,44,46)(H,47,48);9-20,24-26,31H,4-8,21-23H2,1-3H3,(H,41,43)(H,44,45)/t29-,35-;28-,33?;25-,30-;26-,31-/m1111/s1.
What are the key properties of (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid?
(2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid has a molecular weight of 2659.21 g/mol, XLogP of 31.76, 75 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[(2R)-4-(4-butylphenyl)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-(4-propan-2-yloxyphenyl)butanoyl]amino]propanoic acid;(2R)-2-[[(2R)-2-[[4-[5-(4-heptoxyphenyl)pyrimidin-2-yl]phenyl]methyl]-4-oxo-4-[4-(trifluoromethoxy)phenyl]butanoyl]amino]propanoic acid is sourced from PubChem (CID 158103092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).