(3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate

C235H364N24O47 — CID 158468505

About (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate

(3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate (PubChem CID 158468505) has the molecular formula C235H364N24O47 and a molecular weight of 4277.62 g/mol. Its IUPAC name is (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate.

Molecular Properties

• Compound Name: (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate
• PubChem CID: 158468505
• Molecular Formula: C235H364N24O47
• Molecular Weight: 4277.62 g/mol
• Exact Mass: 4274.68
• IUPAC Name: (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate
• SMILES: CCC[C@H](CC(=O)C1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)OC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](CC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H]1CCC(=O)N1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](CC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)c1cccc(=O)[nH]1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](CC(=O)[C@@H](NC(=O)[C@H](CNC(=O)OC)CC(=O)OC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)CC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)OC(C)C)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1
• InChI: InChI=1S/C40H63N5O10.C40H57N3O7.C39H63N5O8.C39H61N3O8.C39H59N3O7.C38H61N5O7/c1-7-12-29(34(48)37(51)42-26-17-18-26)43-36(50)33-27-16-11-15-24(27)22-45(33)38(52)28(40(2,3)4)20-30(46)32(23-13-9-8-10-14-23)44-35(49)25(19-31(47)54-5)21-41-39(53)55-6;1-5-11-26(36(48)33(46)20-24-18-19-24)21-32(45)35-28-15-9-14-27(28)23-43(35)39(50)37(40(2,3)4)42-38(49)29(25-12-7-6-8-13-25)22-31(44)30-16-10-17-34(47)41-30;1-8-13-29(32(46)36(49)41-26-18-19-26)42-35(48)31-27-17-12-16-25(27)21-44(31)37(50)33(39(5,6)7)43-34(47)28(24-14-10-9-11-15-24)20-30(45)23(4)40-38(51)52-22(2)3;1-7-12-26(34(46)32(45)19-24-17-18-24)20-31(44)33-28-16-11-15-27(28)22-42(33)37(48)35(39(3,4)5)41-36(47)29(25-13-9-8-10-14-25)21-30(43)23(2)40-38(49)50-6;1-5-10-25(35(47)32(45)19-23-15-16-23)20-31(44)34-27-14-9-13-26(27)22-42(34)38(49)36(39(2,3)4)41-37(48)28(24-11-7-6-8-12-24)21-30(43)29-17-18-33(46)40-29;1-7-13-28(32(46)36(49)40-25-18-19-25)41-35(48)31-26-17-12-16-24(26)21-43(31)37(50)33(38(4,5)6)42-34(47)27(23-14-10-9-11-15-23)20-29(44)22(3)39-30(45)8-2/h23-29,32-33H,7-22H2,1-6H3,(H,41,53)(H,42,51)(H,43,50)(H,44,49);10,16-17,24-29,35,37H,5-9,11-15,18-23H2,1-4H3,(H,41,47)(H,42,49);22-29,31,33H,8-21H2,1-7H3,(H,40,51)(H,41,49)(H,42,48)(H,43,47);23-29,33,35H,7-22H2,1-6H3,(H,40,49)(H,41,47);23-29,34,36H,5-22H2,1-4H3,(H,40,46)(H,41,48);22-28,31,33H,7-21H2,1-6H3,(H,39,45)(H,40,49)(H,41,48)(H,42,47)/t24-,25-,27-,28+,29-,32-,33-;26-,27+,28+,29+,35+,37-;23-,25+,27+,28+,29+,31+,33-;23-,26-,27+,28+,29+,33?,35-;25-,26+,27+,28+,29+,34+,36-;22-,24+,26+,27+,28+,31+,33-/m011111/s1
• InChIKey: HGBDMUOETCCDFK-ZAVGPTTASA-N
• XLogP: 26.14
• TPSA: 1010.67 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 47
• Rotatable Bonds: 99
• Heavy Atoms: 306
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4277.62
LogP ≤ 5	26.14
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	47

Frequently Asked Questions

What is the IUPAC name of (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate?

The IUPAC name of (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate (CID 158468505) is (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate.

What is the SMILES notation for (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate?

The canonical SMILES for (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate is CCC[C@H](CC(=O)C1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)OC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](CC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H]1CCC(=O)N1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](CC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)c1cccc(=O)[nH]1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)CC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](CC(=O)[C@@H](NC(=O)[C@H](CNC(=O)OC)CC(=O)OC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)CC)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1.CCC[C@H](NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](CC(=O)[C@@H](C)NC(=O)OC(C)C)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1.

What is the InChIKey of (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate?

The InChIKey is HGBDMUOETCCDFK-ZAVGPTTASA-N. The full InChI is InChI=1S/C40H63N5O10.C40H57N3O7.C39H63N5O8.C39H61N3O8.C39H59N3O7.C38H61N5O7/c1-7-12-29(34(48)37(51)42-26-17-18-26)43-36(50)33-27-16-11-15-24(27)22-45(33)38(52)28(40(2,3)4)20-30(46)32(23-13-9-8-10-14-23)44-35(49)25(19-31(47)54-5)21-41-39(53)55-6;1-5-11-26(36(48)33(46)20-24-18-19-24)21-32(45)35-28-15-9-14-27(28)23-43(35)39(50)37(40(2,3)4)42-38(49)29(25-12-7-6-8-13-25)22-31(44)30-16-10-17-34(47)41-30;1-8-13-29(32(46)36(49)41-26-18-19-26)42-35(48)31-27-17-12-16-25(27)21-44(31)37(50)33(39(5,6)7)43-34(47)28(24-14-10-9-11-15-24)20-30(45)23(4)40-38(51)52-22(2)3;1-7-12-26(34(46)32(45)19-24-17-18-24)20-31(44)33-28-16-11-15-27(28)22-42(33)37(48)35(39(3,4)5)41-36(47)29(25-13-9-8-10-14-25)21-30(43)23(2)40-38(49)50-6;1-5-10-25(35(47)32(45)19-23-15-16-23)20-31(44)34-27-14-9-13-26(27)22-42(34)38(49)36(39(2,3)4)41-37(48)28(24-11-7-6-8-12-24)21-30(43)29-17-18-33(46)40-29;1-7-13-28(32(46)36(49)40-25-18-19-25)41-35(48)31-26-17-12-16-24(26)21-43(31)37(50)33(38(4,5)6)42-34(47)27(23-14-10-9-11-15-23)20-29(44)22(3)39-30(45)8-2/h23-29,32-33H,7-22H2,1-6H3,(H,41,53)(H,42,51)(H,43,50)(H,44,49);10,16-17,24-29,35,37H,5-9,11-15,18-23H2,1-4H3,(H,41,47)(H,42,49);22-29,31,33H,8-21H2,1-7H3,(H,40,51)(H,41,49)(H,42,48)(H,43,47);23-29,33,35H,7-22H2,1-6H3,(H,40,49)(H,41,47);23-29,34,36H,5-22H2,1-4H3,(H,40,46)(H,41,48);22-28,31,33H,7-21H2,1-6H3,(H,39,45)(H,40,49)(H,41,48)(H,42,47)/t24-,25-,27-,28+,29-,32-,33-;26-,27+,28+,29+,35+,37-;23-,25+,27+,28+,29+,31+,33-;23-,26-,27+,28+,29+,33?,35-;25-,26+,27+,28+,29+,34+,36-;22-,24+,26+,27+,28+,31+,33-/m011111/s1.

What are the key properties of (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate?

(3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate has a molecular weight of 4277.62 g/mol, XLogP of 26.14, 99 rotatable bonds, 18 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for (3S,3aS,6aR)-2-[(2S)-2-[[(2S,5R)-2-cyclohexyl-4-oxo-5-(propanoylamino)hexanoyl]amino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-(6-oxo-1H-pyridin-2-yl)butanamide;(2S)-N-[(2S)-1-[(3S,3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-2-cyclohexyl-4-oxo-4-[(2S)-5-oxopyrrolidin-2-yl]butanamide;methyl (3S)-4-[[(1S,4S)-4-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl]-1-cyclohexyl-5,5-dimethyl-2-oxohexyl]amino]-3-[(methoxycarbonylamino)methyl]-4-oxobutanoate;methyl N-[(2R,5S)-6-[[(2S)-1-[(3aS,6aR)-3-[(3R)-6-cyclopropyl-4,5-dioxo-3-propylhexanoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate;propan-2-yl N-[(2R,5S)-6-[[(2S)-1-[(3S,3aS,6aR)-3-[[(3S)-1-(cyclopropylamino)-1,2-dioxohexan-3-yl]carbamoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-cyclohexyl-3,6-dioxohexan-2-yl]carbamate is sourced from PubChem (CID 158468505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).