(2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid

C126H183ClN20O30S2 — CID 159911259

About (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid

(2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid (PubChem CID 159911259) has the molecular formula C126H183ClN20O30S2 and a molecular weight of 2557.55 g/mol. Its IUPAC name is (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid.

Molecular Properties

• Compound Name: (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid
• PubChem CID: 159911259
• Molecular Formula: C126H183ClN20O30S2
• Molecular Weight: 2557.55 g/mol
• Exact Mass: 2555.25
• IUPAC Name: (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid
• SMILES: [H]/N=C(\N)NCCC[C@H](CC(=O)[C@H](CCCN/C(N)=N/[H])N(C)C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)(C)SC1CC(=O)N(CCCCCC(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCCCN2C(=O)CC(SCCC(=O)N(C)[C@@H](C)C(=O)O[C@H]3CC(=O)N(C)c4cc(cc(OC)c4Cl)C/C(C)=C/C=C/[C@@H](OC)[C@]4(O)CC(=O)O[C@@H](C4)[C@@H](C)[C@@H]4O[C@@]34C)C2=O)C1=O)C(=O)N1CCC[C@H]1C(=O)C[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)C[C@@H](CC(C)C)C(=O)O)C(C)(C)C
• InChI: InChI=1S/C126H183ClN20O30S2/c1-71(2)54-82(119(169)170)63-92(152)108(123(9,10)11)140-111(161)81(57-78-41-43-83(149)44-42-78)62-91(151)87-37-29-50-144(87)114(164)80(35-27-46-133-121(128)129)61-90(150)86(36-28-47-134-122(130)131)143(17)115(165)88-38-30-51-145(88)118(168)109(137-76(8)148)124(12,13)179-96-65-105(159)146(117(96)167)49-25-21-24-40-99(153)135-70-101(155)138-85(58-77-33-22-20-23-34-77)113(163)139-84(55-72(3)4)112(162)136-69-100(154)132-48-31-52-147-104(158)64-95(116(147)166)178-53-45-102(156)141(15)75(7)120(171)176-98-66-103(157)142(16)89-59-79(60-93(173-18)107(89)127)56-73(5)32-26-39-97(174-19)126(172)67-94(175-106(160)68-126)74(6)110-125(98,14)177-110/h20,22-23,26,32-34,39,41-44,59-60,71-72,74-75,80-82,84-88,94-98,108-110,149,172H,21,24-25,27-31,35-38,40,45-58,61-70H2,1-19H3,(H,132,154)(H,135,153)(H,136,162)(H,137,148)(H,138,155)(H,139,163)(H,140,161)(H,169,170)(H4,128,129,133)(H4,130,131,134)/b39-26+,73-32+/t74-,75+,80-,81-,82-,84+,85+,86+,87+,88+,94+,95?,96?,97-,98+,108-,109-,110+,125+,126-/m1/s1
• InChIKey: VDKBQXREQMYGCS-ZVPMBRTCSA-N
• XLogP: 6.39
• TPSA: 716.37 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 33
• Rotatable Bonds: 63
• Heavy Atoms: 179
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2557.55
LogP ≤ 5	6.39
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid?

The IUPAC name of (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid (CID 159911259) is (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid.

What is the SMILES notation for (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid?

The canonical SMILES for (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid is [H]/N=C(\N)NCCC[C@H](CC(=O)[C@H](CCCN/C(N)=N/[H])N(C)C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(C)=O)C(C)(C)SC1CC(=O)N(CCCCCC(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCCCN2C(=O)CC(SCCC(=O)N(C)[C@@H](C)C(=O)O[C@H]3CC(=O)N(C)c4cc(cc(OC)c4Cl)C/C(C)=C/C=C/[C@@H](OC)[C@]4(O)CC(=O)O[C@@H](C4)[C@@H](C)[C@@H]4O[C@@]34C)C2=O)C1=O)C(=O)N1CCC[C@H]1C(=O)C[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)C[C@@H](CC(C)C)C(=O)O)C(C)(C)C.

What is the InChIKey of (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid?

The InChIKey is VDKBQXREQMYGCS-ZVPMBRTCSA-N. The full InChI is InChI=1S/C126H183ClN20O30S2/c1-71(2)54-82(119(169)170)63-92(152)108(123(9,10)11)140-111(161)81(57-78-41-43-83(149)44-42-78)62-91(151)87-37-29-50-144(87)114(164)80(35-27-46-133-121(128)129)61-90(150)86(36-28-47-134-122(130)131)143(17)115(165)88-38-30-51-145(88)118(168)109(137-76(8)148)124(12,13)179-96-65-105(159)146(117(96)167)49-25-21-24-40-99(153)135-70-101(155)138-85(58-77-33-22-20-23-34-77)113(163)139-84(55-72(3)4)112(162)136-69-100(154)132-48-31-52-147-104(158)64-95(116(147)166)178-53-45-102(156)141(15)75(7)120(171)176-98-66-103(157)142(16)89-59-79(60-93(173-18)107(89)127)56-73(5)32-26-39-97(174-19)126(172)67-94(175-106(160)68-126)74(6)110-125(98,14)177-110/h20,22-23,26,32-34,39,41-44,59-60,71-72,74-75,80-82,84-88,94-98,108-110,149,172H,21,24-25,27-31,35-38,40,45-58,61-70H2,1-19H3,(H,132,154)(H,135,153)(H,136,162)(H,137,148)(H,138,155)(H,139,163)(H,140,161)(H,169,170)(H4,128,129,133)(H4,130,131,134)/b39-26+,73-32+/t74-,75+,80-,81-,82-,84+,85+,86+,87+,88+,94+,95?,96?,97-,98+,108-,109-,110+,125+,126-/m1/s1.

What are the key properties of (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid?

(2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid has a molecular weight of 2557.55 g/mol, XLogP of 6.39, 63 rotatable bonds, 16 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,5S)-5-[[(2R)-4-[(2S)-1-[(2R,5S)-5-[[(2S)-1-[(2R)-2-acetamido-3-[1-[6-[[2-[[(2S)-1-[[(2S)-1-[[2-[3-[3-[3-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21R)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9-azatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylamino]-3-oxopropyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]propylamino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-8-carbamimidamido-2-(3-carbamimidamidopropyl)-4-oxooctanoyl]pyrrolidin-2-yl]-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoyl]amino]-6,6-dimethyl-2-(2-methylpropyl)-4-oxoheptanoic acid is sourced from PubChem (CID 159911259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).