5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate

C183H291F13N11O58P — CID 158657031

About 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate

5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate (PubChem CID 158657031) has the molecular formula C183H291F13N11O58P and a molecular weight of 3851.31 g/mol. Its IUPAC name is 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate.

Molecular Properties

• Compound Name: 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate
• PubChem CID: 158657031
• Molecular Formula: C183H291F13N11O58P
• Molecular Weight: 3851.31 g/mol
• Exact Mass: 3848.97
• IUPAC Name: 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate
• SMILES: CC(=O)NC1[C@H](OCCCCC(=O)CCCCCC(=O)CCOCC(COCCC(=O)CCCCCC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2C)(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2NC(C)=O)NC(=O)CCCC(=O)O)OC(COC(C)=O)[C@H](C)[C@@H]1C.CC(=O)NC1[C@H](OCCCCC(=O)CCCCCC(=O)CCOCC(COCCC(=O)CCCCCC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2C)(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2NC(C)=O)NC(=O)CCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)OC(COC(C)=O)[C@H](C)[C@@H]1C.COP(=O)(O)OCCCCCCN.O=C(Oc1c(F)c(F)c(F)c(F)c1F)C(F)(F)F
• InChI: InChI=1S/C87H136F5N5O26.C81H137N5O26.C8F8O2.C7H18NO4P/c1-53-54(2)69(47-117-62(10)100)120-84(59(53)7)114-41-22-19-31-65(103)27-15-13-17-29-67(105)36-44-111-50-87(97-74(109)34-25-35-75(110)123-83-79(91)77(89)76(88)78(90)80(83)92,51-112-45-37-68(106)30-18-14-16-28-66(104)32-20-23-42-115-85-81(95-60(8)98)57(5)55(3)70(121-85)48-118-63(11)101)52-113-46-38-73(108)94-40-26-39-93-72(107)33-21-24-43-116-86-82(96-61(9)99)58(6)56(4)71(122-86)49-119-64(12)102;1-53-54(2)69(47-107-62(10)89)110-78(59(53)7)104-41-22-19-31-65(92)27-15-13-17-29-67(94)36-44-101-50-81(86-74(98)34-25-35-75(99)100,51-102-45-37-68(95)30-18-14-16-28-66(93)32-20-23-42-105-79-76(84-60(8)87)57(5)55(3)70(111-79)48-108-63(11)90)52-103-46-38-73(97)83-40-26-39-82-72(96)33-21-24-43-106-80-77(85-61(9)88)58(6)56(4)71(112-80)49-109-64(12)91;9-1-2(10)4(12)6(5(13)3(1)11)18-7(17)8(14,15)16;1-11-13(9,10)12-7-5-3-2-4-6-8/h53-59,69-71,81-82,84-86H,13-52H2,1-12H3,(H,93,107)(H,94,108)(H,95,98)(H,96,99)(H,97,109);53-59,69-71,76-80H,13-52H2,1-12H3,(H,82,96)(H,83,97)(H,84,87)(H,85,88)(H,86,98)(H,99,100);;2-8H2,1H3,(H,9,10)/t53-,54+,55+,56+,57-,58-,59?,69?,70?,71?,81?,82?,84+,85+,86+,87?;53-,54+,55+,56+,57-,58-,59?,69?,70?,71?,76?,77?,78+,79+,80+,81?;;/m00../s1
• InChIKey: ICGPOEHWKLPTEH-ZYCITYTLSA-N
• XLogP: 22.34
• TPSA: 923.18 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 57
• Rotatable Bonds: 134
• Heavy Atoms: 266
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3851.31
LogP ≤ 5	22.34
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	57

Frequently Asked Questions

What is the IUPAC name of 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate?

The IUPAC name of 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate (CID 158657031) is 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate.

What is the SMILES notation for 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate?

The canonical SMILES for 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate is CC(=O)NC1[C@H](OCCCCC(=O)CCCCCC(=O)CCOCC(COCCC(=O)CCCCCC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2C)(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2NC(C)=O)NC(=O)CCCC(=O)O)OC(COC(C)=O)[C@H](C)[C@@H]1C.CC(=O)NC1[C@H](OCCCCC(=O)CCCCCC(=O)CCOCC(COCCC(=O)CCCCCC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2C)(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2OC(COC(C)=O)[C@H](C)[C@H](C)C2NC(C)=O)NC(=O)CCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)OC(COC(C)=O)[C@H](C)[C@@H]1C.COP(=O)(O)OCCCCCCN.O=C(Oc1c(F)c(F)c(F)c(F)c1F)C(F)(F)F.

What is the InChIKey of 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate?

The InChIKey is ICGPOEHWKLPTEH-ZYCITYTLSA-N. The full InChI is InChI=1S/C87H136F5N5O26.C81H137N5O26.C8F8O2.C7H18NO4P/c1-53-54(2)69(47-117-62(10)100)120-84(59(53)7)114-41-22-19-31-65(103)27-15-13-17-29-67(105)36-44-111-50-87(97-74(109)34-25-35-75(110)123-83-79(91)77(89)76(88)78(90)80(83)92,51-112-45-37-68(106)30-18-14-16-28-66(104)32-20-23-42-115-85-81(95-60(8)98)57(5)55(3)70(121-85)48-118-63(11)101)52-113-46-38-73(108)94-40-26-39-93-72(107)33-21-24-43-116-86-82(96-61(9)99)58(6)56(4)71(122-86)49-119-64(12)102;1-53-54(2)69(47-107-62(10)89)110-78(59(53)7)104-41-22-19-31-65(92)27-15-13-17-29-67(94)36-44-101-50-81(86-74(98)34-25-35-75(99)100,51-102-45-37-68(95)30-18-14-16-28-66(93)32-20-23-42-105-79-76(84-60(8)87)57(5)55(3)70(111-79)48-108-63(11)90)52-103-46-38-73(97)83-40-26-39-82-72(96)33-21-24-43-106-80-77(85-61(9)88)58(6)56(4)71(112-80)49-109-64(12)91;9-1-2(10)4(12)6(5(13)3(1)11)18-7(17)8(14,15)16;1-11-13(9,10)12-7-5-3-2-4-6-8/h53-59,69-71,81-82,84-86H,13-52H2,1-12H3,(H,93,107)(H,94,108)(H,95,98)(H,96,99)(H,97,109);53-59,69-71,76-80H,13-52H2,1-12H3,(H,82,96)(H,83,97)(H,84,87)(H,85,88)(H,86,98)(H,99,100);;2-8H2,1H3,(H,9,10)/t53-,54+,55+,56+,57-,58-,59?,69?,70?,71?,81?,82?,84+,85+,86+,87?;53-,54+,55+,56+,57-,58-,59?,69?,70?,71?,76?,77?,78+,79+,80+,81?;;/m00../s1.

What are the key properties of 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate?

5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate has a molecular weight of 3851.31 g/mol, XLogP of 22.34, 134 rotatable bonds, 13 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoic acid;6-aminohexyl methyl hydrogen phosphate;(2,3,4,5,6-pentafluorophenyl) 5-[[1-[13-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]-2-[[3-[3-[5-[(2R,4S,5R)-3-acetamido-6-(acetyloxymethyl)-4,5-dimethyloxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]-3-[13-[(2R,4S,5R)-6-(acetyloxymethyl)-3,4,5-trimethyloxan-2-yl]oxy-3,9-dioxotridecoxy]propan-2-yl]amino]-5-oxopentanoate;(2,3,4,5,6-pentafluorophenyl) 2,2,2-trifluoroacetate is sourced from PubChem (CID 158657031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).