3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid

C95H134F3N13O57P6S6 — CID 122491981

IUPAC3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid
SMILESC#CCOc1cc(C(=O)NCCCc2c(OCc3cn(CCCNC(=O)c4cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c4)nn3)cc(C(=O)NCCCCCC(=O)NCCCCCCOP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](C4C=C(C)C(=O)NC4=O)C[C@H]3O)cc2OCc2cn(CCCNC(=O)c3cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c3)nn2)cc(OCC#C)c1CCCNC(=O)C(F)(F)F
InChIInChI=1S/C95H134F3N13O57P6S6/c1-4-34-151-75-50-65(51-76(152-35-5-2)71(75)24-14-29-104-94(120)95(96,97)98)90(116)101-28-13-23-72-77(159-61-69-59-110(108-106-69)32-15-30-102-91(117)67-54-80(153-36-17-43-175(133,134)135)86(157-40-21-47-179(145,146)147)81(55-67)154-37-18-44-176(136,137)138)52-66(53-78(72)160-62-70-60-111(109-107-70)33-16-31-103-92(118)68-56-82(155-38-19-45-177(139,140)141)87(158-41-22-48-180(148,149)150)83(57-68)156-39-20-46-178(142,143)144)89(115)100-27-11-8-9-25-85(113)99-26-10-6-7-12-42-161-169(121,122)164-171(125,126)166-173(129,130)168-174(131,132)167-172(127,128)165-170(123,124)162-63-84-74(112)58-79(163-84)73-49-64(3)88(114)105-93(73)119/h1-2,49-57,59-60,73-74,79,84,112H,6-48,58,61-63H2,3H3,(H,99,113)(H,100,115)(H,101,116)(H,102,117)(H,103,118)(H,104,120)(H,121,122)(H,123,124)(H,125,126)(H,127,128)(H,129,130)(H,131,132)(H,105,114,119)(H,133,134,135)(H,136,137,138)(H,139,140,141)(H,142,143,144)(H,145,146,147)(H,148,149,150)/t73?,74-,79-,84-/m1/s1
InChIKeyYLUVALAIHXIBFQ-AGIREPFSSA-N
MW2805.39 g/mol
LogP5.03
Rot. Bonds88

About 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid

3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid (PubChem CID 122491981) has the molecular formula C95H134F3N13O57P6S6 and a molecular weight of 2805.39 g/mol. Its IUPAC name is 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid.

Molecular Properties

Compound Name3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid
PubChem CID122491981
Molecular FormulaC95H134F3N13O57P6S6
Molecular Weight2805.39 g/mol
Exact Mass2803.47
IUPAC Name3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid
SMILESC#CCOc1cc(C(=O)NCCCc2c(OCc3cn(CCCNC(=O)c4cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c4)nn3)cc(C(=O)NCCCCCC(=O)NCCCCCCOP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](C4C=C(C)C(=O)NC4=O)C[C@H]3O)cc2OCc2cn(CCCNC(=O)c3cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c3)nn2)cc(OCC#C)c1CCCNC(=O)C(F)(F)F
InChIInChI=1S/C95H134F3N13O57P6S6/c1-4-34-151-75-50-65(51-76(152-35-5-2)71(75)24-14-29-104-94(120)95(96,97)98)90(116)101-28-13-23-72-77(159-61-69-59-110(108-106-69)32-15-30-102-91(117)67-54-80(153-36-17-43-175(133,134)135)86(157-40-21-47-179(145,146)147)81(55-67)154-37-18-44-176(136,137)138)52-66(53-78(72)160-62-70-60-111(109-107-70)33-16-31-103-92(118)68-56-82(155-38-19-45-177(139,140)141)87(158-41-22-48-180(148,149)150)83(57-68)156-39-20-46-178(142,143)144)89(115)100-27-11-8-9-25-85(113)99-26-10-6-7-12-42-161-169(121,122)164-171(125,126)166-173(129,130)168-174(131,132)167-172(127,128)165-170(123,124)162-63-84-74(112)58-79(163-84)73-49-64(3)88(114)105-93(73)119/h1-2,49-57,59-60,73-74,79,84,112H,6-48,58,61-63H2,3H3,(H,99,113)(H,100,115)(H,101,116)(H,102,117)(H,103,118)(H,104,120)(H,121,122)(H,123,124)(H,125,126)(H,127,128)(H,129,130)(H,131,132)(H,105,114,119)(H,133,134,135)(H,136,137,138)(H,139,140,141)(H,142,143,144)(H,145,146,147)(H,148,149,150)/t73?,74-,79-,84-/m1/s1
InChIKeyYLUVALAIHXIBFQ-AGIREPFSSA-N
XLogP5.03
TPSA1018.58 Ų
H-Bond Donors20
H-Bond Acceptors51
Rotatable Bonds88
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002805.39
LogP ≤ 55.03
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1051

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid?
The IUPAC name of 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid (CID 122491981) is 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid.
What is the SMILES notation for 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid?
The canonical SMILES for 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid is C#CCOc1cc(C(=O)NCCCc2c(OCc3cn(CCCNC(=O)c4cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c4)nn3)cc(C(=O)NCCCCCC(=O)NCCCCCCOP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](C4C=C(C)C(=O)NC4=O)C[C@H]3O)cc2OCc2cn(CCCNC(=O)c3cc(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c(OCCCS(=O)(=O)O)c3)nn2)cc(OCC#C)c1CCCNC(=O)C(F)(F)F.
What is the InChIKey of 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid?
The InChIKey is YLUVALAIHXIBFQ-AGIREPFSSA-N. The full InChI is InChI=1S/C95H134F3N13O57P6S6/c1-4-34-151-75-50-65(51-76(152-35-5-2)71(75)24-14-29-104-94(120)95(96,97)98)90(116)101-28-13-23-72-77(159-61-69-59-110(108-106-69)32-15-30-102-91(117)67-54-80(153-36-17-43-175(133,134)135)86(157-40-21-47-179(145,146)147)81(55-67)154-37-18-44-176(136,137)138)52-66(53-78(72)160-62-70-60-111(109-107-70)33-16-31-103-92(118)68-56-82(155-38-19-45-177(139,140)141)87(158-41-22-48-180(148,149)150)83(57-68)156-39-20-46-178(142,143)144)89(115)100-27-11-8-9-25-85(113)99-26-10-6-7-12-42-161-169(121,122)164-171(125,126)166-173(129,130)168-174(131,132)167-172(127,128)165-170(123,124)162-63-84-74(112)58-79(163-84)73-49-64(3)88(114)105-93(73)119/h1-2,49-57,59-60,73-74,79,84,112H,6-48,58,61-63H2,3H3,(H,99,113)(H,100,115)(H,101,116)(H,102,117)(H,103,118)(H,104,120)(H,121,122)(H,123,124)(H,125,126)(H,127,128)(H,129,130)(H,131,132)(H,105,114,119)(H,133,134,135)(H,136,137,138)(H,139,140,141)(H,142,143,144)(H,145,146,147)(H,148,149,150)/t73?,74-,79-,84-/m1/s1.
What are the key properties of 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid?
3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid has a molecular weight of 2805.39 g/mol, XLogP of 5.03, 88 rotatable bonds, 20 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[3-[4-[[2-[3-[[3,5-bis(prop-2-ynoxy)-4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzoyl]amino]propyl]-5-[[6-[6-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[hydroxy-[[(2R,3R,5R)-3-hydroxy-5-(5-methyl-2,6-dioxo-3H-pyridin-3-yl)oxolan-2-yl]methoxy]phosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyphosphoryl]oxyhexylamino]-6-oxohexyl]carbamoyl]-3-[[1-[3-[[3,4,5-tris(3-sulfopropoxy)benzoyl]amino]propyl]triazol-4-yl]methoxy]phenoxy]methyl]triazol-1-yl]propylcarbamoyl]-2,3-bis(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid is sourced from PubChem (CID 122491981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).