2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate

C127H170N16O34S15 — CID 157396783

About 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate

2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate (PubChem CID 157396783) has the molecular formula C127H170N16O34S15 and a molecular weight of 2945.84 g/mol. Its IUPAC name is 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate.

Molecular Properties

• Compound Name: 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate
• PubChem CID: 157396783
• Molecular Formula: C127H170N16O34S15
• Molecular Weight: 2945.84 g/mol
• Exact Mass: 2942.79
• IUPAC Name: 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate
• SMILES: CC1(C)S[C@@H]2[C@H](CC(=O)C(N)c3ccccc3)C(=O)N2C1C(=O)OCCSSCCCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C.CC1(C)S[C@@H]2[C@H](CC(=O)C(N)c3ccccc3)C(=O)N2C1C(=O)OCCSSCCCOC(=O)[C@H]1N2C(=O)C[C@@H]2S(=O)(=O)[C@@]1(C)Cn1ccnn1.CC1(C)S[C@H]2[C@@H](NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)OCCSSCCOC(=O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21.CCCC(CCC)C(=O)CCCSSCCOC(=O)c1cccnc1.CCCC(CCC)C(=O)OCCSSCCNC(=O)c1cccnc1
• InChI: InChI=1S/C32H40N6O9S4.C30H39N3O9S4.C28H34N4O10S3.C19H29NO3S2.C18H28N2O3S2/c1-31(2)25(38-27(41)20(28(38)50-31)16-21(39)24(33)19-8-5-4-6-9-19)29(42)47-13-15-49-48-14-7-12-46-30(43)26-32(3,18-36-11-10-34-35-36)51(44,45)23-17-22(40)37(23)26;1-29(2)23(33-25(36)18(26(33)45-29)15-19(34)22(31)17-9-6-5-7-10-17)27(37)42-12-14-44-43-13-8-11-41-28(38)24-30(3,4)46(39,40)21-16-20(35)32(21)24;1-28(2)22(32-24(37)20(25(32)45-28)30-23(36)19(29)14-3-5-15(34)6-4-14)27(39)41-10-12-44-43-11-9-40-26(38)21-16(7-8-33)42-18-13-17(35)31(18)21;1-3-7-16(8-4-2)18(21)10-6-13-24-25-14-12-23-19(22)17-9-5-11-20-15-17;1-3-6-15(7-4-2)18(22)23-11-13-25-24-12-10-20-17(21)16-8-5-9-19-14-16/h4-6,8-11,20,23-26,28H,7,12-18,33H2,1-3H3;5-7,9-10,18,21-24,26H,8,11-16,31H2,1-4H3;3-7,18-22,25,33-34H,8-13,29H2,1-2H3,(H,30,36);5,9,11,15-16H,3-4,6-8,10,12-14H2,1-2H3;5,8-9,14-15H,3-4,6-7,10-13H2,1-2H3,(H,20,21)/b;;16-7-;;/t20-,23+,24?,25?,26-,28-,32+;18-,21-,22?,23?,24+,26-;18-,19?,20+,21-,22?,25+;;/m111../s1
• InChIKey: BMQXEFDXNZRJIU-CYIIAEQRSA-N
• XLogP: 13.28
• TPSA: 694.19 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 55
• Rotatable Bonds: 70
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2945.84
LogP ≤ 5	13.28
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	55

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate?

The IUPAC name of 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate (CID 157396783) is 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate.

What is the SMILES notation for 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate?

The canonical SMILES for 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate is CC1(C)S[C@@H]2[C@H](CC(=O)C(N)c3ccccc3)C(=O)N2C1C(=O)OCCSSCCCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C.CC1(C)S[C@@H]2[C@H](CC(=O)C(N)c3ccccc3)C(=O)N2C1C(=O)OCCSSCCCOC(=O)[C@H]1N2C(=O)C[C@@H]2S(=O)(=O)[C@@]1(C)Cn1ccnn1.CC1(C)S[C@H]2[C@@H](NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)OCCSSCCOC(=O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21.CCCC(CCC)C(=O)CCCSSCCOC(=O)c1cccnc1.CCCC(CCC)C(=O)OCCSSCCNC(=O)c1cccnc1.

What is the InChIKey of 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate?

The InChIKey is BMQXEFDXNZRJIU-CYIIAEQRSA-N. The full InChI is InChI=1S/C32H40N6O9S4.C30H39N3O9S4.C28H34N4O10S3.C19H29NO3S2.C18H28N2O3S2/c1-31(2)25(38-27(41)20(28(38)50-31)16-21(39)24(33)19-8-5-4-6-9-19)29(42)47-13-15-49-48-14-7-12-46-30(43)26-32(3,18-36-11-10-34-35-36)51(44,45)23-17-22(40)37(23)26;1-29(2)23(33-25(36)18(26(33)45-29)15-19(34)22(31)17-9-6-5-7-10-17)27(37)42-12-14-44-43-13-8-11-41-28(38)24-30(3,4)46(39,40)21-16-20(35)32(21)24;1-28(2)22(32-24(37)20(25(32)45-28)30-23(36)19(29)14-3-5-15(34)6-4-14)27(39)41-10-12-44-43-11-9-40-26(38)21-16(7-8-33)42-18-13-17(35)31(18)21;1-3-7-16(8-4-2)18(21)10-6-13-24-25-14-12-23-19(22)17-9-5-11-20-15-17;1-3-6-15(7-4-2)18(22)23-11-13-25-24-12-10-20-17(21)16-8-5-9-19-14-16/h4-6,8-11,20,23-26,28H,7,12-18,33H2,1-3H3;5-7,9-10,18,21-24,26H,8,11-16,31H2,1-4H3;3-7,18-22,25,33-34H,8-13,29H2,1-2H3,(H,30,36);5,9,11,15-16H,3-4,6-8,10,12-14H2,1-2H3;5,8-9,14-15H,3-4,6-7,10-13H2,1-2H3,(H,20,21)/b;;16-7-;;/t20-,23+,24?,25?,26-,28-,32+;18-,21-,22?,23?,24+,26-;18-,19?,20+,21-,22?,25+;;/m111../s1.

What are the key properties of 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate?

2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate has a molecular weight of 2945.84 g/mol, XLogP of 13.28, 70 rotatable bonds, 7 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[(5S,6S)-6-[[2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxyethyldisulfanyl]ethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[3-[(2R,3S,5S)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxypropyldisulfanyl]ethyl (5R,6R)-6-(3-amino-2-oxo-3-phenylpropyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;2-[(4-oxo-5-propyloctyl)disulfanyl]ethyl pyridine-3-carboxylate;2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl 2-propylpentanoate is sourced from PubChem (CID 157396783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).