5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid

C107H166N22O48 — CID 140540986

About 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid

5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid (PubChem CID 140540986) has the molecular formula C107H166N22O48 and a molecular weight of 2528.61 g/mol. Its IUPAC name is 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid.

Molecular Properties

• Compound Name: 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid
• PubChem CID: 140540986
• Molecular Formula: C107H166N22O48
• Molecular Weight: 2528.61 g/mol
• Exact Mass: 2527.12
• IUPAC Name: 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid
• SMILES: [H]/N=C(\N)NCCCC(NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CO)NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(Cc1c[nH]cn1)NC(=O)C(CCC(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)CCCC(C)=O)C(C)C)C(C)O[C@H]1O[C@@H](CO)[C@H](O)C(O[C@@H]2O[C@@H](CO)[C@H](O)C(O)C2O)C1NC(C)=O)C(C)O[C@H]1O[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)C(O)C2NC(C)=O)[C@H](O)C(O[C@@H]2O[C@@H](CO)[C@H](O)C(O)C2O)C1NC(C)=O)C(=O)N1CCCC1C(=O)NC(C)C(C)=O
• InChI: InChI=1S/C107H166N22O48/c1-43(2)72(125-69(141)35-112-90(156)58(32-54-34-110-42-113-54)122-91(157)55(26-27-70(142)143)120-92(158)57(31-53-20-13-12-14-21-53)119-68(140)25-15-19-44(3)135)97(163)127-74(49(8)169-103-76(117-51(10)138)88(81(149)66(40-134)172-103)176-105-86(154)84(152)79(147)64(38-132)173-105)99(165)124-60(36-130)94(160)115-46(5)100(166)128-29-17-24-62(128)96(162)123-59(33-71(144)145)93(159)126-73(98(164)121-56(22-16-28-111-107(108)109)101(167)129-30-18-23-61(129)95(161)114-45(4)47(6)136)48(7)170-104-77(118-52(11)139)89(177-106-87(155)85(153)80(148)65(39-133)174-106)82(150)67(175-104)41-168-102-75(116-50(9)137)83(151)78(146)63(37-131)171-102/h12-14,20-21,34,42-43,45-46,48-49,55-67,72-89,102-106,130-134,146-155H,15-19,22-33,35-41H2,1-11H3,(H,110,113)(H,112,156)(H,114,161)(H,115,160)(H,116,137)(H,117,138)(H,118,139)(H,119,140)(H,120,158)(H,121,164)(H,122,157)(H,123,162)(H,124,165)(H,125,141)(H,126,159)(H,127,163)(H,142,143)(H,144,145)(H4,108,109,111)/t45?,46?,48?,49?,55?,56?,57?,58?,59?,60?,61?,62?,63-,64-,65-,66-,67-,72?,73?,74?,75?,76?,77?,78+,79-,80-,81-,82-,83?,84?,85?,86?,87?,88?,89?,102+,103-,104-,105-,106-/m0/s1
• InChIKey: BRIZXMNZUHEIFH-FXOTWTMRSA-N
• XLogP: -17.42
• TPSA: 1072.19 Ų
• H-Bond Donors: 36
• H-Bond Acceptors: 48
• Rotatable Bonds: 65
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2528.61
LogP ≤ 5	-17.42
H-Bond Donors ≤ 5	36
H-Bond Acceptors ≤ 10	48

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'}

Frequently Asked Questions

What is the IUPAC name of 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid?

The IUPAC name of 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid (CID 140540986) is 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid.

What is the SMILES notation for 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid?

The canonical SMILES for 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid is [H]/N=C(\N)NCCCC(NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CO)NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(Cc1c[nH]cn1)NC(=O)C(CCC(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)CCCC(C)=O)C(C)C)C(C)O[C@H]1O[C@@H](CO)[C@H](O)C(O[C@@H]2O[C@@H](CO)[C@H](O)C(O)C2O)C1NC(C)=O)C(C)O[C@H]1O[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)C(O)C2NC(C)=O)[C@H](O)C(O[C@@H]2O[C@@H](CO)[C@H](O)C(O)C2O)C1NC(C)=O)C(=O)N1CCCC1C(=O)NC(C)C(C)=O.

What is the InChIKey of 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid?

The InChIKey is BRIZXMNZUHEIFH-FXOTWTMRSA-N. The full InChI is InChI=1S/C107H166N22O48/c1-43(2)72(125-69(141)35-112-90(156)58(32-54-34-110-42-113-54)122-91(157)55(26-27-70(142)143)120-92(158)57(31-53-20-13-12-14-21-53)119-68(140)25-15-19-44(3)135)97(163)127-74(49(8)169-103-76(117-51(10)138)88(81(149)66(40-134)172-103)176-105-86(154)84(152)79(147)64(38-132)173-105)99(165)124-60(36-130)94(160)115-46(5)100(166)128-29-17-24-62(128)96(162)123-59(33-71(144)145)93(159)126-73(98(164)121-56(22-16-28-111-107(108)109)101(167)129-30-18-23-61(129)95(161)114-45(4)47(6)136)48(7)170-104-77(118-52(11)139)89(177-106-87(155)85(153)80(148)65(39-133)174-106)82(150)67(175-104)41-168-102-75(116-50(9)137)83(151)78(146)63(37-131)171-102/h12-14,20-21,34,42-43,45-46,48-49,55-67,72-89,102-106,130-134,146-155H,15-19,22-33,35-41H2,1-11H3,(H,110,113)(H,112,156)(H,114,161)(H,115,160)(H,116,137)(H,117,138)(H,118,139)(H,119,140)(H,120,158)(H,121,164)(H,122,157)(H,123,162)(H,124,165)(H,125,141)(H,126,159)(H,127,163)(H,142,143)(H,144,145)(H4,108,109,111)/t45?,46?,48?,49?,55?,56?,57?,58?,59?,60?,61?,62?,63-,64-,65-,66-,67-,72?,73?,74?,75?,76?,77?,78+,79-,80-,81-,82-,83?,84?,85?,86?,87?,88?,89?,102+,103-,104-,105-,106-/m0/s1.

What are the key properties of 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid?

5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid has a molecular weight of 2528.61 g/mol, XLogP of -17.42, 65 rotatable bonds, 36 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[[1-[[2-[[1-[[1-[[1-[[1-[2-[[1-[[3-[(2S,5R,6S)-3-acetamido-6-[[(2R,5S,6S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-hydroxy-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[5-carbamimidamido-1-oxo-1-[2-(3-oxobutan-2-ylcarbamoyl)pyrrolidin-1-yl]pentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-[(2S,5R,6S)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxo-4-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]pentanoic acid is sourced from PubChem (CID 140540986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).