[7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate

C176H326N17O99P5 — CID 163948660

About [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate

[7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate (PubChem CID 163948660) has the molecular formula C176H326N17O99P5 and a molecular weight of 4419.43 g/mol. Its IUPAC name is [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate.

Molecular Properties

• Compound Name: [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate
• PubChem CID: 163948660
• Molecular Formula: C176H326N17O99P5
• Molecular Weight: 4419.43 g/mol
• Exact Mass: 4416.97
• IUPAC Name: [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate
• SMILES: CC(=O)NC1C(OCCCC(=O)NCCCCCCCC(=O)OCCCC(C)(CCCOC(=O)NCCCCCCNC(=O)CCCOC2OC(CO)C(O)C(O)C2NC(C)=O)CCCOC(=O)NCCCCCCNC(=O)CCCOC2OC(CO)C(O)C(O)C2NC(C)=O)OC(CO)C(O)C1O.CC(COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O)(COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O)COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O.COCC1OC(OCCOCCOCCNC(=O)CCOCC(C)(COCCC(=O)NCCOCCOCCOC2OC(COP(=O)(O)O)C(O)C(O)C2O)COCCC(=O)NCCOCCOCCOC2OC(COP(=O)(O)O)C(O)C(O)C2O)C(O)C(O)C1O
• InChI: InChI=1S/C69H124N8O27.C56H105N6O36P3.C51H97N3O36P2/c1-45(81)75-55-61(91)58(88)48(42-78)102-64(55)97-36-18-24-51(84)70-31-13-7-5-6-12-27-54(87)96-39-21-28-69(4,29-22-40-100-67(94)73-34-16-10-8-14-32-71-52(85)25-19-37-98-65-56(76-46(2)82)62(92)59(89)49(43-79)103-65)30-23-41-101-68(95)74-35-17-11-9-15-33-72-53(86)26-20-38-99-66-57(77-47(3)83)63(93)60(90)50(44-80)104-66;1-56(32-87-26-14-41(66)60-20-8-17-57-38(63)11-2-5-23-90-53-50(75)47(72)44(69)35(96-53)29-93-99(78,79)80,33-88-27-15-42(67)61-21-9-18-58-39(64)12-3-6-24-91-54-51(76)48(73)45(70)36(97-54)30-94-100(81,82)83)34-89-28-16-43(68)62-22-10-19-59-40(65)13-4-7-25-92-55-52(77)49(74)46(71)37(98-55)31-95-101(84,85)86;1-51(30-80-9-3-36(55)52-6-12-74-15-18-77-21-24-83-48-45(64)42(61)39(58)33(88-48)27-73-2,31-81-10-4-37(56)53-7-13-75-16-19-78-22-25-84-49-46(65)43(62)40(59)34(89-49)28-86-91(67,68)69)32-82-11-5-38(57)54-8-14-76-17-20-79-23-26-85-50-47(66)44(63)41(60)35(90-50)29-87-92(70,71)72/h48-50,55-66,78-80,88-93H,5-44H2,1-4H3,(H,70,84)(H,71,85)(H,72,86)(H,73,94)(H,74,95)(H,75,81)(H,76,82)(H,77,83);35-37,44-55,69-77H,2-34H2,1H3,(H,57,63)(H,58,64)(H,59,65)(H,60,66)(H,61,67)(H,62,68)(H2,78,79,80)(H2,81,82,83)(H2,84,85,86);33-35,39-50,58-66H,3-32H2,1-2H3,(H,52,55)(H,53,56)(H,54,57)(H2,67,68,69)(H2,70,71,72)
• InChIKey: RXJJCNYHGWNLRN-UHFFFAOYSA-N
• XLogP: -15.25
• TPSA: 1705.60 Ų
• H-Bond Donors: 54
• H-Bond Acceptors: 89
• Rotatable Bonds: 162
• Heavy Atoms: 297
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4419.43
LogP ≤ 5	-15.25
H-Bond Donors ≤ 5	54
H-Bond Acceptors ≤ 10	89

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate?

The IUPAC name of [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate (CID 163948660) is [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate.

What is the SMILES notation for [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate?

The canonical SMILES for [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate is CC(=O)NC1C(OCCCC(=O)NCCCCCCCC(=O)OCCCC(C)(CCCOC(=O)NCCCCCCNC(=O)CCCOC2OC(CO)C(O)C(O)C2NC(C)=O)CCCOC(=O)NCCCCCCNC(=O)CCCOC2OC(CO)C(O)C(O)C2NC(C)=O)OC(CO)C(O)C1O.CC(COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O)(COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O)COCCC(=O)NCCCNC(=O)CCCCOC1OC(COP(=O)(O)O)C(O)C(O)C1O.COCC1OC(OCCOCCOCCNC(=O)CCOCC(C)(COCCC(=O)NCCOCCOCCOC2OC(COP(=O)(O)O)C(O)C(O)C2O)COCCC(=O)NCCOCCOCCOC2OC(COP(=O)(O)O)C(O)C(O)C2O)C(O)C(O)C1O.

What is the InChIKey of [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate?

The InChIKey is RXJJCNYHGWNLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H124N8O27.C56H105N6O36P3.C51H97N3O36P2/c1-45(81)75-55-61(91)58(88)48(42-78)102-64(55)97-36-18-24-51(84)70-31-13-7-5-6-12-27-54(87)96-39-21-28-69(4,29-22-40-100-67(94)73-34-16-10-8-14-32-71-52(85)25-19-37-98-65-56(76-46(2)82)62(92)59(89)49(43-79)103-65)30-23-41-101-68(95)74-35-17-11-9-15-33-72-53(86)26-20-38-99-66-57(77-47(3)83)63(93)60(90)50(44-80)104-66;1-56(32-87-26-14-41(66)60-20-8-17-57-38(63)11-2-5-23-90-53-50(75)47(72)44(69)35(96-53)29-93-99(78,79)80,33-88-27-15-42(67)61-21-9-18-58-39(64)12-3-6-24-91-54-51(76)48(73)45(70)36(97-54)30-94-100(81,82)83)34-89-28-16-43(68)62-22-10-19-59-40(65)13-4-7-25-92-55-52(77)49(74)46(71)37(98-55)31-95-101(84,85)86;1-51(30-80-9-3-36(55)52-6-12-74-15-18-77-21-24-83-48-45(64)42(61)39(58)33(88-48)27-73-2,31-81-10-4-37(56)53-7-13-75-16-19-78-22-25-84-49-46(65)43(62)40(59)34(89-49)28-86-91(67,68)69)32-82-11-5-38(57)54-8-14-76-17-20-79-23-26-85-50-47(66)44(63)41(60)35(90-50)29-87-92(70,71)72/h48-50,55-66,78-80,88-93H,5-44H2,1-4H3,(H,70,84)(H,71,85)(H,72,86)(H,73,94)(H,74,95)(H,75,81)(H,76,82)(H,77,83);35-37,44-55,69-77H,2-34H2,1H3,(H,57,63)(H,58,64)(H,59,65)(H,60,66)(H,61,67)(H,62,68)(H2,78,79,80)(H2,81,82,83)(H2,84,85,86);33-35,39-50,58-66H,3-32H2,1-2H3,(H,52,55)(H,53,56)(H,54,57)(H2,67,68,69)(H2,70,71,72).

What are the key properties of [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate?

[7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate has a molecular weight of 4419.43 g/mol, XLogP of -15.25, 162 rotatable bonds, 54 hydrogen bond donors, and 89 hydrogen bond acceptors.

Where does this data come from?

All data for [7-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]-4-[3-[6-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]hexylcarbamoyloxy]propyl]-4-methylheptyl] 8-[4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoylamino]octanoate;[3,4,5-trihydroxy-6-[2-[2-[2-[3-[2-methyl-2-[[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(methoxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]methyl]-3-[3-oxo-3-[2-[2-[2-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyethoxy]ethoxy]ethylamino]propoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]oxan-2-yl]methyl dihydrogen phosphate;[3,4,5-trihydroxy-6-[5-[3-[3-[2-methyl-3-[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]-2-[[3-oxo-3-[3-[5-[3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]propoxy]methyl]propoxy]propanoylamino]propylamino]-5-oxopentoxy]oxan-2-yl]methyl dihydrogen phosphate is sourced from PubChem (CID 163948660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).