[(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate

C153H209N21O57 — CID 91492033

About [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate

[(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate (PubChem CID 91492033) has the molecular formula C153H209N21O57 and a molecular weight of 3254.44 g/mol. Its IUPAC name is [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate.

Molecular Properties

• Compound Name: [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate
• PubChem CID: 91492033
• Molecular Formula: C153H209N21O57
• Molecular Weight: 3254.44 g/mol
• Exact Mass: 3252.41
• IUPAC Name: [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate
• SMILES: [H]/N=C(\NC)NCCCC(NC(=O)C(NC(=O)C(CC(C)=O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CC)NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)C(CCC(C)=O)NC(=O)C(Cc1ccccc1)NC(=O)CCCC(C)=O)C(C)C)C(C)O[C@H]1O[C@@H](CO[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)C(OC(C)=O)C2NC(C)=O)[C@H](O)C(O[C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1NC(C)=O)C(C)O[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)C(O[C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1NC(C)=O)C(=O)N1CCCC1C(C)=O
• InChI: InChI=1S/C153H209N21O57/c1-28-103(137(199)159-78(7)145(207)174-62-44-56-110(174)141(203)168-106(63-77(6)177)140(202)170-119(144(206)166-105(54-42-60-156-152(154)155-27)146(208)173-61-43-55-109(173)79(8)178)80(9)215-149-123(162-84(13)181)131(126(217-90(19)187)113(227-149)70-210-86(15)183)231-151-135(224-97(26)194)133(222-95(24)192)128(219-92(21)189)115(229-151)72-212-88(17)185)164-143(205)120(81(10)214-148-121(160-82(11)179)129(230-150-134(223-96(25)193)132(221-94(23)191)127(218-91(20)188)114(228-150)71-211-87(16)184)124(197)111(225-148)68-213-147-122(161-83(12)180)130(220-93(22)190)125(216-89(18)186)112(226-147)69-209-85(14)182)171-142(204)118(74(2)3)169-117(196)66-157-136(198)108(65-102-67-172(73-158-102)153(99-48-35-30-36-49-99,100-50-37-31-38-51-100)101-52-39-32-40-53-101)167-138(200)104(59-58-76(5)176)165-139(201)107(64-98-46-33-29-34-47-98)163-116(195)57-41-45-75(4)175/h29-40,46-53,67,73-74,78,80-81,103-115,118-135,147-151,197H,28,41-45,54-66,68-72H2,1-27H3,(H,157,198)(H,159,199)(H,160,179)(H,161,180)(H,162,181)(H,163,195)(H,164,205)(H,165,201)(H,166,206)(H,167,200)(H,168,203)(H,169,196)(H,170,202)(H,171,204)(H3,154,155,156)/t78?,80?,81?,103?,104?,105?,106?,107?,108?,109?,110?,111-,112-,113-,114-,115-,118?,119?,120?,121?,122?,123?,124-,125+,126+,127-,128-,129?,130?,131?,132?,133?,134?,135?,147+,148-,149-,150-,151-/m0/s1
• InChIKey: ZYWUQBWMFNKQAU-QSMXUWMYSA-N
• XLogP: -2.50
• TPSA: 1036.46 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 60
• Rotatable Bonds: 80
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3254.44
LogP ≤ 5	-2.50
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	60

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate?

The IUPAC name of [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate (CID 91492033) is [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate.

What is the SMILES notation for [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate?

The canonical SMILES for [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate is [H]/N=C(\NC)NCCCC(NC(=O)C(NC(=O)C(CC(C)=O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CC)NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)C(CCC(C)=O)NC(=O)C(Cc1ccccc1)NC(=O)CCCC(C)=O)C(C)C)C(C)O[C@H]1O[C@@H](CO[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)C(OC(C)=O)C2NC(C)=O)[C@H](O)C(O[C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1NC(C)=O)C(C)O[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)C(O[C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1NC(C)=O)C(=O)N1CCCC1C(C)=O.

What is the InChIKey of [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate?

The InChIKey is ZYWUQBWMFNKQAU-QSMXUWMYSA-N. The full InChI is InChI=1S/C153H209N21O57/c1-28-103(137(199)159-78(7)145(207)174-62-44-56-110(174)141(203)168-106(63-77(6)177)140(202)170-119(144(206)166-105(54-42-60-156-152(154)155-27)146(208)173-61-43-55-109(173)79(8)178)80(9)215-149-123(162-84(13)181)131(126(217-90(19)187)113(227-149)70-210-86(15)183)231-151-135(224-97(26)194)133(222-95(24)192)128(219-92(21)189)115(229-151)72-212-88(17)185)164-143(205)120(81(10)214-148-121(160-82(11)179)129(230-150-134(223-96(25)193)132(221-94(23)191)127(218-91(20)188)114(228-150)71-211-87(16)184)124(197)111(225-148)68-213-147-122(161-83(12)180)130(220-93(22)190)125(216-89(18)186)112(226-147)69-209-85(14)182)171-142(204)118(74(2)3)169-117(196)66-157-136(198)108(65-102-67-172(73-158-102)153(99-48-35-30-36-49-99,100-50-37-31-38-51-100)101-52-39-32-40-53-101)167-138(200)104(59-58-76(5)176)165-139(201)107(64-98-46-33-29-34-47-98)163-116(195)57-41-45-75(4)175/h29-40,46-53,67,73-74,78,80-81,103-115,118-135,147-151,197H,28,41-45,54-66,68-72H2,1-27H3,(H,157,198)(H,159,199)(H,160,179)(H,161,180)(H,162,181)(H,163,195)(H,164,205)(H,165,201)(H,166,206)(H,167,200)(H,168,203)(H,169,196)(H,170,202)(H,171,204)(H3,154,155,156)/t78?,80?,81?,103?,104?,105?,106?,107?,108?,109?,110?,111-,112-,113-,114-,115-,118?,119?,120?,121?,122?,123?,124-,125+,126+,127-,128-,129?,130?,131?,132?,133?,134?,135?,147+,148-,149-,150-,151-/m0/s1.

What are the key properties of [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate?

[(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate has a molecular weight of 3254.44 g/mol, XLogP of -2.50, 80 rotatable bonds, 18 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for [(2S,3S,6R)-5-acetamido-6-[[(2S,3R,6S)-5-acetamido-6-[4-[[1-[[1-[2-[[1-[[3-[(2S,5S,6S)-3-acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1-[[1-(2-acetylpyrrolidin-1-yl)-5-[(N-methylcarbamimidoyl)amino]-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-[[3-methyl-2-[[2-[[2-[[5-oxo-2-[[2-(5-oxohexanoylamino)-3-phenylpropanoyl]amino]hexanoyl]amino]-3-(1-tritylimidazol-4-yl)propanoyl]amino]acetyl]amino]butanoyl]amino]-4-oxobutan-2-yl]oxy-3-hydroxy-4-[(2R,5S,6S)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-3,4-diacetyloxyoxan-2-yl]methyl acetate is sourced from PubChem (CID 91492033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).