decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate

C253H446N18Na10O124S6-4 — CID 158103633

About decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate

decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate (PubChem CID 158103633) has the molecular formula C253H446N18Na10O124S6-4 and a molecular weight of 6146.66 g/mol. Its IUPAC name is decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate.

Molecular Properties

• Compound Name: decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate
• PubChem CID: 158103633
• Molecular Formula: C253H446N18Na10O124S6-4
• Molecular Weight: 6146.66 g/mol
• Exact Mass: 6142.65
• IUPAC Name: decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate
• SMILES: CCC1OC(OC2C(C(=O)[O-])OC(OCCCCCCNC(=O)CCCCCCCCC(=O)CCOCCCOCCC(=O)CCCCCCCCC(=O)NCCCCCCOC3OC(C(=O)[O-])C(OC4OC(COS(=O)(=O)[O-])C(O)C(O)C4NC(C)=O)C(O)C3O)C(O)C2O)C(NC(C)=O)C(O)C1O.CCC1OC(OCCCCCCNC(=O)CCOCCOCCOCCCNC(=O)CCOCCCOCCC(=O)NCCOCCOCCOCCC(=O)NCCCCCCOC2OC(COS(=O)(=O)[O-])C(O)C(O)C2NC(C)=O)C(NC(C)=O)C(O)C1O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.[CH2-]C1OC(OC2C(C(=O)[O-])OC(OCCCCCCCC(=O)CCCCCCCNC(=O)CCOCC(C)(C)COCCC(=O)NCCCCCCCC(=O)CCCCCCCOC3OC(C(=O)[O-])C(OC4OC([CH2-])C(O)C(O)C4NC(C)=O)C(O)C3O)C(O)C2O)C(NC(C)=O)C(O)C1O.[CH2-]C1OC(OCCCCCCCC(=O)CCOCCOCCOCCNC(=O)CCOCC(C)(C)COCCC(=O)CCCOCCOCCOCCC(=O)NCCCCCCOC2OC([CH2-])C(O)C(O)C2NC(C)=O)C(NC(C)=O)C(O)C1O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: InChI=1S/C69H118N4O28.C68H118N4O32S.C59H106N4O22.C57H106N6O26S.10Na.4H2O4S/c1-41-51(80)53(82)49(72-43(3)74)65(96-41)98-59-55(84)57(86)67(100-61(59)63(88)89)94-35-25-17-9-13-21-29-45(76)27-19-11-7-15-23-33-70-47(78)31-37-92-39-69(5,6)40-93-38-32-48(79)71-34-24-16-8-12-20-28-46(77)30-22-14-10-18-26-36-95-68-58(87)56(85)60(62(101-68)64(90)91)99-66-50(73-44(4)75)54(83)52(81)42(2)97-66;1-4-45-51(79)53(81)49(71-41(2)73)65(99-45)101-59-55(83)57(85)67(103-61(59)63(87)88)96-36-23-15-13-21-32-69-47(77)28-19-11-7-5-9-17-26-43(75)30-38-94-34-25-35-95-39-31-44(76)27-18-10-6-8-12-20-29-48(78)70-33-22-14-16-24-37-97-68-58(86)56(84)60(62(104-68)64(89)90)102-66-50(72-42(3)74)54(82)52(80)46(100-66)40-98-105(91,92)93;1-43-53(70)55(72)51(62-45(3)64)57(84-43)82-26-14-10-7-8-12-17-47(66)19-28-75-34-38-79-40-36-77-32-24-61-50(69)22-31-81-42-59(5,6)41-80-29-20-48(67)18-16-25-74-33-37-78-39-35-76-30-21-49(68)60-23-13-9-11-15-27-83-58-52(63-46(4)65)56(73)54(71)44(2)85-58;1-4-44-52(70)54(72)50(62-42(2)64)56(88-44)85-26-11-7-5-9-19-58-46(66)17-30-80-34-38-83-37-33-79-23-13-21-60-48(68)15-28-77-24-14-25-78-29-16-49(69)61-22-32-82-36-40-84-39-35-81-31-18-47(67)59-20-10-6-8-12-27-86-57-51(63-43(3)65)55(73)53(71)45(89-57)41-87-90(74,75)76;;;;;;;;;;;4*1-5(2,3)4/h41-42,49-62,65-68,80-87H,1-2,7-40H2,3-6H3,(H,70,78)(H,71,79)(H,72,74)(H,73,75)(H,88,89)(H,90,91);45-46,49-62,65-68,79-86H,4-40H2,1-3H3,(H,69,77)(H,70,78)(H,71,73)(H,72,74)(H,87,88)(H,89,90)(H,91,92,93);43-44,51-58,70-73H,1-2,7-42H2,3-6H3,(H,60,68)(H,61,69)(H,62,64)(H,63,65);44-45,50-57,70-73H,4-41H2,1-3H3,(H,58,66)(H,59,67)(H,60,68)(H,61,69)(H,62,64)(H,63,65)(H,74,75,76);;;;;;;;;;;4*(H2,1,2,3,4)/q-2;;-2;;10*+1;;;;/p-10
• InChIKey: LTDCITQIOPGGAY-UHFFFAOYSA-D
• XLogP: -39.48
• TPSA: 2120.96 Ų
• H-Bond Donors: 46
• H-Bond Acceptors: 120
• Rotatable Bonds: 219
• Heavy Atoms: 411
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	6146.66
LogP ≤ 5	-39.48
H-Bond Donors ≤ 5	46
H-Bond Acceptors ≤ 10	120

Frequently Asked Questions

What is the IUPAC name of decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate?

The IUPAC name of decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate (CID 158103633) is decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate.

What is the SMILES notation for decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate?

The canonical SMILES for decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate is CCC1OC(OC2C(C(=O)[O-])OC(OCCCCCCNC(=O)CCCCCCCCC(=O)CCOCCCOCCC(=O)CCCCCCCCC(=O)NCCCCCCOC3OC(C(=O)[O-])C(OC4OC(COS(=O)(=O)[O-])C(O)C(O)C4NC(C)=O)C(O)C3O)C(O)C2O)C(NC(C)=O)C(O)C1O.CCC1OC(OCCCCCCNC(=O)CCOCCOCCOCCCNC(=O)CCOCCCOCCC(=O)NCCOCCOCCOCCC(=O)NCCCCCCOC2OC(COS(=O)(=O)[O-])C(O)C(O)C2NC(C)=O)C(NC(C)=O)C(O)C1O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.[CH2-]C1OC(OC2C(C(=O)[O-])OC(OCCCCCCCC(=O)CCCCCCCNC(=O)CCOCC(C)(C)COCCC(=O)NCCCCCCCC(=O)CCCCCCCOC3OC(C(=O)[O-])C(OC4OC([CH2-])C(O)C(O)C4NC(C)=O)C(O)C3O)C(O)C2O)C(NC(C)=O)C(O)C1O.[CH2-]C1OC(OCCCCCCCC(=O)CCOCCOCCOCCNC(=O)CCOCC(C)(C)COCCC(=O)CCCOCCOCCOCCC(=O)NCCCCCCOC2OC([CH2-])C(O)C(O)C2NC(C)=O)C(NC(C)=O)C(O)C1O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].

What is the InChIKey of decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate?

The InChIKey is LTDCITQIOPGGAY-UHFFFAOYSA-D. The full InChI is InChI=1S/C69H118N4O28.C68H118N4O32S.C59H106N4O22.C57H106N6O26S.10Na.4H2O4S/c1-41-51(80)53(82)49(72-43(3)74)65(96-41)98-59-55(84)57(86)67(100-61(59)63(88)89)94-35-25-17-9-13-21-29-45(76)27-19-11-7-15-23-33-70-47(78)31-37-92-39-69(5,6)40-93-38-32-48(79)71-34-24-16-8-12-20-28-46(77)30-22-14-10-18-26-36-95-68-58(87)56(85)60(62(101-68)64(90)91)99-66-50(73-44(4)75)54(83)52(81)42(2)97-66;1-4-45-51(79)53(81)49(71-41(2)73)65(99-45)101-59-55(83)57(85)67(103-61(59)63(87)88)96-36-23-15-13-21-32-69-47(77)28-19-11-7-5-9-17-26-43(75)30-38-94-34-25-35-95-39-31-44(76)27-18-10-6-8-12-20-29-48(78)70-33-22-14-16-24-37-97-68-58(86)56(84)60(62(104-68)64(89)90)102-66-50(72-42(3)74)54(82)52(80)46(100-66)40-98-105(91,92)93;1-43-53(70)55(72)51(62-45(3)64)57(84-43)82-26-14-10-7-8-12-17-47(66)19-28-75-34-38-79-40-36-77-32-24-61-50(69)22-31-81-42-59(5,6)41-80-29-20-48(67)18-16-25-74-33-37-78-39-35-76-30-21-49(68)60-23-13-9-11-15-27-83-58-52(63-46(4)65)56(73)54(71)44(2)85-58;1-4-44-52(70)54(72)50(62-42(2)64)56(88-44)85-26-11-7-5-9-19-58-46(66)17-30-80-34-38-83-37-33-79-23-13-21-60-48(68)15-28-77-24-14-25-78-29-16-49(69)61-22-32-82-36-40-84-39-35-81-31-18-47(67)59-20-10-6-8-12-27-86-57-51(63-43(3)65)55(73)53(71)45(89-57)41-87-90(74,75)76;;;;;;;;;;;4*1-5(2,3)4/h41-42,49-62,65-68,80-87H,1-2,7-40H2,3-6H3,(H,70,78)(H,71,79)(H,72,74)(H,73,75)(H,88,89)(H,90,91);45-46,49-62,65-68,79-86H,4-40H2,1-3H3,(H,69,77)(H,70,78)(H,71,73)(H,72,74)(H,87,88)(H,89,90)(H,91,92,93);43-44,51-58,70-73H,1-2,7-42H2,3-6H3,(H,60,68)(H,61,69)(H,62,64)(H,63,65);44-45,50-57,70-73H,4-41H2,1-3H3,(H,58,66)(H,59,67)(H,60,68)(H,61,69)(H,62,64)(H,63,65)(H,74,75,76);;;;;;;;;;;4*(H2,1,2,3,4)/q-2;;-2;;10*+1;;;;/p-10.

What are the key properties of decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate?

decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate has a molecular weight of 6146.66 g/mol, XLogP of -39.48, 219 rotatable bonds, 46 hydrogen bond donors, and 120 hydrogen bond acceptors.

Where does this data come from?

All data for decasodium;[5-acetamido-6-[6-[3-[2-[2-[2-[3-[3-[3-[3-[2-[2-[3-[6-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxyhexylamino]-3-oxopropoxy]ethoxy]ethoxy]propylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoylamino]hexoxy]-3,4-dihydroxyoxan-2-yl]methyl sulfate;3-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-[15-[3-[3-[3-[[15-[5-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxy-8-oxopentadecyl]amino]-3-oxopropoxy]-2,2-dimethylpropoxy]propanoylamino]-8-oxopentadecoxy]-4,5-dihydroxyoxane-2-carboxylate;N-[6-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxyhexyl]-3-[2-[2-[6-[3-[3-[2-[2-[2-[10-(3-acetamido-4,5-dihydroxy-6-methanidyloxan-2-yl)oxy-3-oxodecoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2,2-dimethylpropoxy]-4-oxohexoxy]ethoxy]ethoxy]propanamide;6-[6-[[12-[3-[12-[6-[5-[3-acetamido-4,5-dihydroxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyhexylamino]-3,12-dioxododecoxy]propoxy]-10-oxododecanoyl]amino]hexoxy]-3-(3-acetamido-6-ethyl-4,5-dihydroxyoxan-2-yl)oxy-4,5-dihydroxyoxane-2-carboxylate;hydrogen sulfate is sourced from PubChem (CID 158103633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).