4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione

C131H178N8O36 — CID 158777499

About 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione

4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione (PubChem CID 158777499) has the molecular formula C131H178N8O36 and a molecular weight of 2440.88 g/mol. Its IUPAC name is 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione.

Molecular Properties

• Compound Name: 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione
• PubChem CID: 158777499
• Molecular Formula: C131H178N8O36
• Molecular Weight: 2440.88 g/mol
• Exact Mass: 2439.23
• IUPAC Name: 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione
• SMILES: CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)C/N=C(\C)c3ccc(OCCCC(=O)O)cc3)O2)O[C@@H]1C.CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)C/N=C(\C)c3ccc(OCCCC(=O)ON4C(=O)CCC4=O)cc3)O2)O[C@@H]1C.CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)CN)O2)O[C@@H]1C.CC(=O)c1ccc(OCCCC(=O)O)cc1.O=C1CCC(=O)N1O
• InChI: InChI=1S/C45H59N3O12.C41H56N2O10.C29H44N2O7.C12H14O4.C4H5NO3/c1-28(10-17-40-29(2)22-39(32(5)58-40)47-41(51)18-11-30(3)57-33(6)49)9-14-37-24-45(27-56-45)25-38(59-37)23-35(50)26-46-31(4)34-12-15-36(16-13-34)55-21-7-8-44(54)60-48-42(52)19-20-43(48)53;1-26(10-17-38-27(2)20-37(30(5)52-38)43-39(46)18-11-28(3)51-31(6)44)9-14-35-22-41(25-50-41)23-36(53-35)21-33(45)24-42-29(4)32-12-15-34(16-13-32)49-19-7-8-40(47)48;1-18(6-9-24-14-29(17-35-29)15-25(38-24)13-23(33)16-30)7-10-27-19(2)12-26(21(4)37-27)31-28(34)11-8-20(3)36-22(5)32;1-9(13)10-4-6-11(7-5-10)16-8-2-3-12(14)15;6-3-1-2-4(7)5(3)8/h9-16,18,29-30,32,37-40H,7-8,17,19-27H2,1-6H3,(H,47,51);9-16,18,27-28,30,35-38H,7-8,17,19-25H2,1-6H3,(H,43,46)(H,47,48);6-9,11,19-21,24-27H,10,12-17,30H2,1-5H3,(H,31,34);4-7H,2-3,8H2,1H3,(H,14,15);8H,1-2H2/b14-9+,18-11-,28-10+,46-31+;14-9+,18-11-,26-10+,42-29+;9-6+,11-8-,18-7+;;/t29-,30-,32+,37+,38+,39+,40-,45+;27-,28-,30+,35+,36+,37+,38-,41+;19-,20-,21+,24+,25+,26+,27-,29+;;/m000../s1
• InChIKey: IQQPGWOTVALSHK-BGLOXNNOSA-N
• XLogP: 15.53
• TPSA: 601.77 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 37
• Rotatable Bonds: 54
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2440.88
LogP ≤ 5	15.53
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione?

The IUPAC name of 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione (CID 158777499) is 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione.

What is the SMILES notation for 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione?

The canonical SMILES for 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione is CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)C/N=C(\C)c3ccc(OCCCC(=O)O)cc3)O2)O[C@@H]1C.CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)C/N=C(\C)c3ccc(OCCCC(=O)ON4C(=O)CCC4=O)cc3)O2)O[C@@H]1C.CC(=O)O[C@@H](C)/C=C\C(=O)N[C@@H]1C[C@H](C)[C@H](C/C=C(C)/C=C/[C@@H]2C[C@]3(CO3)C[C@@H](CC(=O)CN)O2)O[C@@H]1C.CC(=O)c1ccc(OCCCC(=O)O)cc1.O=C1CCC(=O)N1O.

What is the InChIKey of 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione?

The InChIKey is IQQPGWOTVALSHK-BGLOXNNOSA-N. The full InChI is InChI=1S/C45H59N3O12.C41H56N2O10.C29H44N2O7.C12H14O4.C4H5NO3/c1-28(10-17-40-29(2)22-39(32(5)58-40)47-41(51)18-11-30(3)57-33(6)49)9-14-37-24-45(27-56-45)25-38(59-37)23-35(50)26-46-31(4)34-12-15-36(16-13-34)55-21-7-8-44(54)60-48-42(52)19-20-43(48)53;1-26(10-17-38-27(2)20-37(30(5)52-38)43-39(46)18-11-28(3)51-31(6)44)9-14-35-22-41(25-50-41)23-36(53-35)21-33(45)24-42-29(4)32-12-15-34(16-13-32)49-19-7-8-40(47)48;1-18(6-9-24-14-29(17-35-29)15-25(38-24)13-23(33)16-30)7-10-27-19(2)12-26(21(4)37-27)31-28(34)11-8-20(3)36-22(5)32;1-9(13)10-4-6-11(7-5-10)16-8-2-3-12(14)15;6-3-1-2-4(7)5(3)8/h9-16,18,29-30,32,37-40H,7-8,17,19-27H2,1-6H3,(H,47,51);9-16,18,27-28,30,35-38H,7-8,17,19-25H2,1-6H3,(H,43,46)(H,47,48);6-9,11,19-21,24-27H,10,12-17,30H2,1-5H3,(H,31,34);4-7H,2-3,8H2,1H3,(H,14,15);8H,1-2H2/b14-9+,18-11-,28-10+,46-31+;14-9+,18-11-,26-10+,42-29+;9-6+,11-8-,18-7+;;/t29-,30-,32+,37+,38+,39+,40-,45+;27-,28-,30+,35+,36+,37+,38-,41+;19-,20-,21+,24+,25+,26+,27-,29+;;/m000../s1.

What are the key properties of 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione?

4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione has a molecular weight of 2440.88 g/mol, XLogP of 15.53, 54 rotatable bonds, 7 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoic acid;4-(4-acetylphenoxy)butanoic acid;[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3S,5S,7S)-7-(3-amino-2-oxopropyl)-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate;(2,5-dioxopyrrolidin-1-yl) 4-[4-[N-[3-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]-2-oxopropyl]-C-methylcarbonimidoyl]phenoxy]butanoate;1-hydroxypyrrolidine-2,5-dione is sourced from PubChem (CID 158777499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).