1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione

C158H243N5O28S4 — CID 161446692

About 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione

1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione (PubChem CID 161446692) has the molecular formula C158H243N5O28S4 and a molecular weight of 2788.96 g/mol. Its IUPAC name is 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione.

Molecular Properties

• Compound Name: 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione
• PubChem CID: 161446692
• Molecular Formula: C158H243N5O28S4
• Molecular Weight: 2788.96 g/mol
• Exact Mass: 2786.66
• IUPAC Name: 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione
• SMILES: C#CCCC(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)C(C)(C)C)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CC.C#CCCC(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)c3ccccc3)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CCC=C.C=CCCC(=O)C(=O)C(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)CCC(C)C)CCCCC1)C(C)(C)C)C2(C)C)CC1CC1.CC(C)C[C@](C)(CC(=O)C[C@H](C(=O)N1CC2[C@@H]([C@H]1C(=O)CC(CC1CCC1)C(=O)C(N)=O)C2(C)C)C(C)(C)C)CS(=O)(=O)C(C)(C)C
• InChI: InChI=1S/C42H57NO7S.C41H65NO7S.C38H59NO7S.C37H62N2O7S/c1-8-10-18-29(38(47)34(45)21-11-9-2)24-35(46)37-36-33(41(36,6)7)27-43(37)39(48)32(40(3,4)5)25-30(44)26-42(22-16-13-17-23-42)28-51(49,50)31-19-14-12-15-20-31;1-9-10-14-33(44)37(46)29(21-28-15-16-28)22-34(45)36-35-32(40(35,7)8)25-42(36)38(47)31(39(4,5)6)23-30(43)24-41(18-12-11-13-19-41)26-50(48,49)20-17-27(2)3;1-11-13-17-25(33(43)29(41)12-2)20-30(42)32-31-28(37(31,9)10)23-39(32)34(44)27(35(3,4)5)21-26(40)22-38(18-15-14-16-19-38)24-47(45,46)36(6,7)8;1-22(2)18-37(11,21-47(45,46)35(6,7)8)19-25(40)17-26(34(3,4)5)33(44)39-20-27-29(36(27,9)10)30(39)28(41)16-24(31(42)32(38)43)15-23-13-12-14-23/h1,9,12,14-15,19-20,29,32-33,36-37H,2,10-11,13,16-18,21-28H2,3-7H3;9,27-29,31-32,35-36H,1,10-26H2,2-8H3;1,25,27-28,31-32H,12-24H2,2-10H3;22-24,26-27,29-30H,12-21H2,1-11H3,(H2,38,43)/t29?,32-,33?,36+,37-;29?,31-,32?,35+,36-;25?,27-,28?,31+,32-;24?,26-,27?,29+,30-,37-/m1111/s1
• InChIKey: VZZJAUSUNWLJGD-USDKPDLRSA-N
• XLogP: 26.12
• TPSA: 516.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 28
• Rotatable Bonds: 69
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2788.96
LogP ≤ 5	26.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The IUPAC name of 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione (CID 161446692) is 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione.

What is the SMILES notation for 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The canonical SMILES for 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione is C#CCCC(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)C(C)(C)C)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CC.C#CCCC(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)c3ccccc3)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CCC=C.C=CCCC(=O)C(=O)C(CC(=O)[C@@H]1[C@@H]2C(CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)CCC(C)C)CCCCC1)C(C)(C)C)C2(C)C)CC1CC1.CC(C)C[C@](C)(CC(=O)C[C@H](C(=O)N1CC2[C@@H]([C@H]1C(=O)CC(CC1CCC1)C(=O)C(N)=O)C2(C)C)C(C)(C)C)CS(=O)(=O)C(C)(C)C.

What is the InChIKey of 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The InChIKey is VZZJAUSUNWLJGD-USDKPDLRSA-N. The full InChI is InChI=1S/C42H57NO7S.C41H65NO7S.C38H59NO7S.C37H62N2O7S/c1-8-10-18-29(38(47)34(45)21-11-9-2)24-35(46)37-36-33(41(36,6)7)27-43(37)39(48)32(40(3,4)5)25-30(44)26-42(22-16-13-17-23-42)28-51(49,50)31-19-14-12-15-20-31;1-9-10-14-33(44)37(46)29(21-28-15-16-28)22-34(45)36-35-32(40(35,7)8)25-42(36)38(47)31(39(4,5)6)23-30(43)24-41(18-12-11-13-19-41)26-50(48,49)20-17-27(2)3;1-11-13-17-25(33(43)29(41)12-2)20-30(42)32-31-28(37(31,9)10)23-39(32)34(44)27(35(3,4)5)21-26(40)22-38(18-15-14-16-19-38)24-47(45,46)36(6,7)8;1-22(2)18-37(11,21-47(45,46)35(6,7)8)19-25(40)17-26(34(3,4)5)33(44)39-20-27-29(36(27,9)10)30(39)28(41)16-24(31(42)32(38)43)15-23-13-12-14-23/h1,9,12,14-15,19-20,29,32-33,36-37H,2,10-11,13,16-18,21-28H2,3-7H3;9,27-29,31-32,35-36H,1,10-26H2,2-8H3;1,25,27-28,31-32H,12-24H2,2-10H3;22-24,26-27,29-30H,12-21H2,1-11H3,(H2,38,43)/t29?,32-,33?,36+,37-;29?,31-,32?,35+,36-;25?,27-,28?,31+,32-;24?,26-,27?,29+,30-,37-/m1111/s1.

What are the key properties of 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione has a molecular weight of 2788.96 g/mol, XLogP of 26.12, 69 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(1R,2S)-3-[(2S)-5-[1-(benzenesulfonylmethyl)cyclohexyl]-2-tert-butyl-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylnon-8-ene-1,4,5-trione;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(tert-butylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-but-3-ynylheptane-1,4,5-trione;5-[(1R,2S)-3-[(2S,6R)-2-tert-butyl-6-(tert-butylsulfonylmethyl)-6,8-dimethyl-4-oxononanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclobutylmethyl)-2,5-dioxopentanamide;1-[(1R,2S)-3-[(2S)-2-tert-butyl-5-[1-(3-methylbutylsulfonylmethyl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione is sourced from PubChem (CID 161446692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).