(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid

C239H441BrN8O81 — CID 159392662

IUPAC(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid
SMILESC.C.CC.CC(=O)C[C@@H](CCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(C)(C)C(=O)CCOCCOCCOCCOCCOCCOCCCC(=O)CBr.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)NCCCOCCCNC(=O)CCc1cn(CCOCCC(=O)C(C)(C)C)nn1.Cc1c(C)c2c(c(C)c1OCC(=O)C[C@@H](CCC(=O)C(C)C)C(=O)O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2
InChIInChI=1S/C62H119NO29.C40H66O6.C38H71NO17.C24H41NO10.C23H41N5O5.C22H41BrO8.2C13H24O3.C2H6.2CH4/c1-57(2)61(66)8-10-70-12-14-72-16-18-74-20-22-76-24-26-78-28-30-80-32-34-82-36-38-84-40-42-86-44-46-88-48-50-90-52-54-92-56-55-91-53-51-89-49-47-87-45-43-85-41-39-83-37-35-81-33-31-79-29-27-77-25-23-75-21-19-73-17-15-71-13-11-69-9-4-5-59(65)6-7-60(62(67)68)63-58(3)64;1-26(2)14-11-15-28(5)16-12-17-29(6)18-13-22-40(10)23-21-35-32(9)37(30(7)31(8)38(35)46-40)45-25-34(41)24-33(39(43)44)19-20-36(42)27(3)4;1-33(2)37(42)8-10-46-12-14-48-16-18-50-20-22-52-24-26-54-28-30-56-32-31-55-29-27-53-25-23-51-21-19-49-17-15-47-13-11-45-9-4-5-35(41)6-7-36(38(43)44)39-34(3)40;1-18(2)22(28)17-35-14-11-32-9-4-5-21(27)16-34-13-12-33-10-8-25-23(29)7-6-20(24(30)31)15-19(3)26;1-5-21(30)24-11-6-14-32-15-7-12-25-22(31)9-8-19-18-28(27-26-19)13-17-33-16-10-20(29)23(2,3)4;1-22(2,3)21(25)6-8-27-10-12-29-14-16-31-18-17-30-15-13-28-11-9-26-7-4-5-20(24)19-23;2*1-5-11(14)7-6-9-16-10-8-12(15)13(2,3)4;1-2;;/h57,60H,4-56H2,1-3H3,(H,63,64)(H,67,68);26-29,33H,11-25H2,1-10H3,(H,43,44);33,36H,4-32H2,1-3H3,(H,39,40)(H,43,44);18,20H,4-17H2,1-3H3,(H,25,29)(H,30,31);18H,5-17H2,1-4H3,(H,24,30)(H,25,31);4-19H2,1-3H3;2*5-10H2,1-4H3;1-2H3;2*1H4/t60-;28-,29-,33-,40-;36-;20-;;;;;;;/m0101......./s1
InChIKeyLMHWQJSVVAAATE-XHBLBZOPSA-N
MW4803.04 g/mol
LogP26.96
Rot. Bonds231

About (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid

(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid (PubChem CID 159392662) has the molecular formula C239H441BrN8O81 and a molecular weight of 4803.04 g/mol. Its IUPAC name is (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid.

Molecular Properties

Compound Name(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid
PubChem CID159392662
Molecular FormulaC239H441BrN8O81
Molecular Weight4803.04 g/mol
Exact Mass4798.98
IUPAC Name(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid
SMILESC.C.CC.CC(=O)C[C@@H](CCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(C)(C)C(=O)CCOCCOCCOCCOCCOCCOCCCC(=O)CBr.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)NCCCOCCCNC(=O)CCc1cn(CCOCCC(=O)C(C)(C)C)nn1.Cc1c(C)c2c(c(C)c1OCC(=O)C[C@@H](CCC(=O)C(C)C)C(=O)O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2
InChIInChI=1S/C62H119NO29.C40H66O6.C38H71NO17.C24H41NO10.C23H41N5O5.C22H41BrO8.2C13H24O3.C2H6.2CH4/c1-57(2)61(66)8-10-70-12-14-72-16-18-74-20-22-76-24-26-78-28-30-80-32-34-82-36-38-84-40-42-86-44-46-88-48-50-90-52-54-92-56-55-91-53-51-89-49-47-87-45-43-85-41-39-83-37-35-81-33-31-79-29-27-77-25-23-75-21-19-73-17-15-71-13-11-69-9-4-5-59(65)6-7-60(62(67)68)63-58(3)64;1-26(2)14-11-15-28(5)16-12-17-29(6)18-13-22-40(10)23-21-35-32(9)37(30(7)31(8)38(35)46-40)45-25-34(41)24-33(39(43)44)19-20-36(42)27(3)4;1-33(2)37(42)8-10-46-12-14-48-16-18-50-20-22-52-24-26-54-28-30-56-32-31-55-29-27-53-25-23-51-21-19-49-17-15-47-13-11-45-9-4-5-35(41)6-7-36(38(43)44)39-34(3)40;1-18(2)22(28)17-35-14-11-32-9-4-5-21(27)16-34-13-12-33-10-8-25-23(29)7-6-20(24(30)31)15-19(3)26;1-5-21(30)24-11-6-14-32-15-7-12-25-22(31)9-8-19-18-28(27-26-19)13-17-33-16-10-20(29)23(2,3)4;1-22(2,3)21(25)6-8-27-10-12-29-14-16-31-18-17-30-15-13-28-11-9-26-7-4-5-20(24)19-23;2*1-5-11(14)7-6-9-16-10-8-12(15)13(2,3)4;1-2;;/h57,60H,4-56H2,1-3H3,(H,63,64)(H,67,68);26-29,33H,11-25H2,1-10H3,(H,43,44);33,36H,4-32H2,1-3H3,(H,39,40)(H,43,44);18,20H,4-17H2,1-3H3,(H,25,29)(H,30,31);18H,5-17H2,1-4H3,(H,24,30)(H,25,31);4-19H2,1-3H3;2*5-10H2,1-4H3;1-2H3;2*1H4/t60-;28-,29-,33-,40-;36-;20-;;;;;;;/m0101......./s1
InChIKeyLMHWQJSVVAAATE-XHBLBZOPSA-N
XLogP26.96
TPSA1078.49 Ų
H-Bond Donors9
H-Bond Acceptors80
Rotatable Bonds231
Heavy Atoms329
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004803.04
LogP ≤ 526.96
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1080

Analyze (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid with MolForge

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Launch Full Analysis

Related Compounds

(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;tris(N-[2-[2-[5-[2-(3,3-dimethyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethyl]acetamide);4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one;tris((2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid);(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid
CID 158051968
(2S)-2-acetamido-5-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethylamino]-5-oxopentanoic acid;(2S)-2-acetamido-8-(4-methyl-3-oxopentoxy)-5-oxooctanoic acid;4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one
CID 158317107
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[6-[2-[2-[2-[2-[[1-(5-methylhexyl)triazol-4-yl]methoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-oxohexoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 162030365
(2S)-2-amino-N'-[2-[2-[2-[2-[[(5Z,8Z,11Z,14Z)-octadeca-5,8,11,14-tetraenoyl]amino]ethoxy]ethoxy]ethoxy]ethyl]-N-[6-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]hexyl]pentanediamide
CID 176550054
(4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-5-[6-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]hexylamino]pentanoic acid
CID 169175624
4-[(12R)-15-[2-[2-[5-[2-[2-[[(5R,9R)-9-acetyl-13-[[2-[2-[2-[[2-[2-[(7S)-7-carboxy-7-[10-(4-carboxyphenoxy)decanoylamino]-4-oxoheptoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]-5-(3,3-dimethyl-2-oxobutyl)-6-oxotridecyl]amino]-2-oxoethoxy]ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-12-carboxy-10,15-dioxopentadecoxy]benzoic acid
CID 157346635
3-[1-(5-methylheptyl)triazol-4-yl]-N-[2-[2-(3-methyl-2-oxopentoxy)ethoxy]ethyl]propanamide
CID 138737710
4-[(12R)-15-[2-[2-[5-[2-[2-[[(5R,9R)-5-acetyl-9-[4-[[2-[2-[2-[[2-[2-[2-[[(4S)-4-carboxy-4-[10-(4-carboxyphenoxy)decanoylamino]butanoyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]butyl]-12,12-dimethyl-8,11-dioxotridecyl]amino]-2-oxoethoxy]ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-12-carboxy-10,15-dioxopentadecoxy]benzoic acid
CID 161218715
2-[[4-carboxy-4-[4-[4-[2-oxo-17-(2H-tetrazol-5-yl)heptadecyl]sulfonylbutanoylamino]butanoylamino]butanoyl]amino]-5-[2-[2-[2-(4,4-dimethyl-3-oxopentoxy)ethoxy]ethoxy]ethylamino]-5-oxopentanoic acid;(2S)-2-[[(4S)-4-carboxy-4-[12-[4-[2-oxo-17-(2H-tetrazol-5-yl)heptadecyl]sulfonylbutanoylamino]dodecanoylamino]butanoyl]amino]-5-oxo-8-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-5-[2-[2-oxo-5-[2-(2-oxopropoxy)ethoxy]pentoxy]ethoxy]pentoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]octanoic acid;bis(20-[[4-[[(1R)-1-carboxypropyl]carbamoyl]cyclohexyl]methylamino]-20-oxoicosanoic acid);N-[2-[2-[5-[2-(3,3-dimethyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethyl]acetamide;2-[2-(4-oxohexoxy)ethoxy]-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]acetamide
CID 160725905
4-oxo-4-[[2-oxo-2-[[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl]oxy]ethyl]amino]butanoic acid
CID 155629610
(2R)-2-[6-[2-[5-[2-[2-[2-[2-(3-methyl-2-oxobutoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]-2-oxopentoxy]ethoxy]-3-oxohexyl]-4-oxotricosanedioic acid
CID 158500711
(2R)-2-[6-[2-[5-[2-[2-[2-[2-(3-methyl-2-oxobutoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]-2-oxopentoxy]ethoxy]-3-oxohexyl]-4-oxohenicosanedioic acid
CID 148552673

Frequently Asked Questions

What is the IUPAC name of (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid?
The IUPAC name of (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid (CID 159392662) is (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid.
What is the SMILES notation for (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid?
The canonical SMILES for (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid is C.C.CC.CC(=O)C[C@@H](CCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(=O)N[C@@H](CCC(=O)CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)C(C)C)C(=O)O.CC(C)(C)C(=O)CCOCCOCCOCCOCCOCCOCCCC(=O)CBr.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)CCCOCCC(=O)C(C)(C)C.CCC(=O)NCCCOCCCNC(=O)CCc1cn(CCOCCC(=O)C(C)(C)C)nn1.Cc1c(C)c2c(c(C)c1OCC(=O)C[C@@H](CCC(=O)C(C)C)C(=O)O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2.
What is the InChIKey of (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid?
The InChIKey is LMHWQJSVVAAATE-XHBLBZOPSA-N. The full InChI is InChI=1S/C62H119NO29.C40H66O6.C38H71NO17.C24H41NO10.C23H41N5O5.C22H41BrO8.2C13H24O3.C2H6.2CH4/c1-57(2)61(66)8-10-70-12-14-72-16-18-74-20-22-76-24-26-78-28-30-80-32-34-82-36-38-84-40-42-86-44-46-88-48-50-90-52-54-92-56-55-91-53-51-89-49-47-87-45-43-85-41-39-83-37-35-81-33-31-79-29-27-77-25-23-75-21-19-73-17-15-71-13-11-69-9-4-5-59(65)6-7-60(62(67)68)63-58(3)64;1-26(2)14-11-15-28(5)16-12-17-29(6)18-13-22-40(10)23-21-35-32(9)37(30(7)31(8)38(35)46-40)45-25-34(41)24-33(39(43)44)19-20-36(42)27(3)4;1-33(2)37(42)8-10-46-12-14-48-16-18-50-20-22-52-24-26-54-28-30-56-32-31-55-29-27-53-25-23-51-21-19-49-17-15-47-13-11-45-9-4-5-35(41)6-7-36(38(43)44)39-34(3)40;1-18(2)22(28)17-35-14-11-32-9-4-5-21(27)16-34-13-12-33-10-8-25-23(29)7-6-20(24(30)31)15-19(3)26;1-5-21(30)24-11-6-14-32-15-7-12-25-22(31)9-8-19-18-28(27-26-19)13-17-33-16-10-20(29)23(2,3)4;1-22(2,3)21(25)6-8-27-10-12-29-14-16-31-18-17-30-15-13-28-11-9-26-7-4-5-20(24)19-23;2*1-5-11(14)7-6-9-16-10-8-12(15)13(2,3)4;1-2;;/h57,60H,4-56H2,1-3H3,(H,63,64)(H,67,68);26-29,33H,11-25H2,1-10H3,(H,43,44);33,36H,4-32H2,1-3H3,(H,39,40)(H,43,44);18,20H,4-17H2,1-3H3,(H,25,29)(H,30,31);18H,5-17H2,1-4H3,(H,24,30)(H,25,31);4-19H2,1-3H3;2*5-10H2,1-4H3;1-2H3;2*1H4/t60-;28-,29-,33-,40-;36-;20-;;;;;;;/m0101......./s1.
What are the key properties of (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid?
(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid has a molecular weight of 4803.04 g/mol, XLogP of 26.96, 231 rotatable bonds, 9 hydrogen bond donors, and 80 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;(2S)-2-acetamido-8-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(4-methyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-oxooctanoic acid;1-[2-[2-[2-[2-[2-(5-bromo-4-oxopentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;bis(4,4-dimethyl-1-(4-oxohexoxy)pentan-3-one);3-[1-[2-(4,4-dimethyl-3-oxopentoxy)ethyl]triazol-4-yl]-N-[3-[3-(propanoylamino)propoxy]propyl]propanamide;ethane;methane;(2R)-5-[2-[2-[5-[2-(3-methyl-2-oxobutoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-5-oxo-2-(2-oxopropyl)pentanoic acid;(2R)-6-methyl-5-oxo-2-[2-oxo-3-[[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl]oxy]propyl]heptanoic acid is sourced from PubChem (CID 159392662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).