carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid

C250H444N12O81S6 — CID 159704701

IUPACcarbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid
SMILESCC(C)(C)OC(=O)C(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)NC(=O)CCCCCCCSCCCCCCCC(=O)C(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)COCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NCCOCCOCC(=O)CC(CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.O=C=O
InChIInChI=1S/C45H80N2O15S.C45H80N2O14S.C45H81NO11S.C42H75N3O15S.2C36H64N2O12S.CO2/c1-43(2,3)60-40(53)36(23-22-34(48)19-14-16-24-56-26-28-58-29-27-57-25-17-15-20-35(49)31-59-32-39(51)52)46-38(50)21-13-11-10-12-18-30-63-33-37(41(54)61-44(4,5)6)47-42(55)62-45(7,8)9;1-43(2,3)59-40(53)36(24-22-34(48)19-14-16-26-56-28-30-58-31-29-57-27-17-15-20-35(49)23-25-39(51)52)46-38(50)21-13-11-10-12-18-32-62-33-37(41(54)60-44(4,5)6)47-42(55)61-45(7,8)9;1-44(2,3)40(49)23-13-9-7-11-19-35-58-36-20-12-8-10-14-24-41(50)46-39(43(53)57-45(4,5)6)27-25-37(47)21-15-17-29-54-31-33-56-34-32-55-30-18-16-22-38(48)26-28-42(51)52;1-40(2,3)58-37(51)32(19-18-31(46)16-15-21-54-23-25-56-28-35(48)43-20-22-55-24-26-57-29-36(49)50)44-34(47)17-13-11-10-12-14-27-61-30-33(38(52)59-41(4,5)6)45-39(53)60-42(7,8)9;1-34(2,3)48-31(43)27(19-18-26(39)16-15-20-46-21-22-47-24-30(41)42)37-29(40)17-13-11-10-12-14-23-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;1-34(2,3)48-31(43)26(16-17-30(41)42)23-27(39)24-47-21-20-46-19-18-37-29(40)15-13-11-10-12-14-22-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;2-1-3/h36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);39H,7-36H2,1-6H3,(H,46,50)(H,51,52);32-33H,10-30H2,1-9H3,(H,43,48)(H,44,47)(H,45,53)(H,49,50);27-28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);26,28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);
InChIKeyMYBGFJOJZLGVDU-UHFFFAOYSA-N
MW5106.71 g/mol
LogP37.37
Rot. Bonds199

About carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid

carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid (PubChem CID 159704701) has the molecular formula C250H444N12O81S6 and a molecular weight of 5106.71 g/mol. Its IUPAC name is carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid.

Molecular Properties

Compound Namecarbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid
PubChem CID159704701
Molecular FormulaC250H444N12O81S6
Molecular Weight5106.71 g/mol
Exact Mass5102.93
IUPAC Namecarbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid
SMILESCC(C)(C)OC(=O)C(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)NC(=O)CCCCCCCSCCCCCCCC(=O)C(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)COCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NCCOCCOCC(=O)CC(CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.O=C=O
InChIInChI=1S/C45H80N2O15S.C45H80N2O14S.C45H81NO11S.C42H75N3O15S.2C36H64N2O12S.CO2/c1-43(2,3)60-40(53)36(23-22-34(48)19-14-16-24-56-26-28-58-29-27-57-25-17-15-20-35(49)31-59-32-39(51)52)46-38(50)21-13-11-10-12-18-30-63-33-37(41(54)61-44(4,5)6)47-42(55)62-45(7,8)9;1-43(2,3)59-40(53)36(24-22-34(48)19-14-16-26-56-28-30-58-31-29-57-27-17-15-20-35(49)23-25-39(51)52)46-38(50)21-13-11-10-12-18-32-62-33-37(41(54)60-44(4,5)6)47-42(55)61-45(7,8)9;1-44(2,3)40(49)23-13-9-7-11-19-35-58-36-20-12-8-10-14-24-41(50)46-39(43(53)57-45(4,5)6)27-25-37(47)21-15-17-29-54-31-33-56-34-32-55-30-18-16-22-38(48)26-28-42(51)52;1-40(2,3)58-37(51)32(19-18-31(46)16-15-21-54-23-25-56-28-35(48)43-20-22-55-24-26-57-29-36(49)50)44-34(47)17-13-11-10-12-14-27-61-30-33(38(52)59-41(4,5)6)45-39(53)60-42(7,8)9;1-34(2,3)48-31(43)27(19-18-26(39)16-15-20-46-21-22-47-24-30(41)42)37-29(40)17-13-11-10-12-14-23-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;1-34(2,3)48-31(43)26(16-17-30(41)42)23-27(39)24-47-21-20-46-19-18-37-29(40)15-13-11-10-12-14-22-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;2-1-3/h36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);39H,7-36H2,1-6H3,(H,46,50)(H,51,52);32-33H,10-30H2,1-9H3,(H,43,48)(H,44,47)(H,45,53)(H,49,50);27-28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);26,28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);
InChIKeyMYBGFJOJZLGVDU-UHFFFAOYSA-N
XLogP37.37
TPSA1279.43 Ų
H-Bond Donors18
H-Bond Acceptors81
Rotatable Bonds199
Heavy Atoms349
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005106.71
LogP ≤ 537.37
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1081

Analyze carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid with MolForge

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Launch Full Analysis

Related Compounds

4-[(2-methylpropan-2-yl)oxycarbonyl]-6-oxo-7-[2-[2-[[2-[2-(4-oxononadecoxy)ethoxy]acetyl]amino]ethoxy]ethoxy]heptanoic acid
CID 157141662
2-[2-[5-[2-[2-[[(4S)-5-[(2-methylpropan-2-yl)oxy]-4-[[18-[(2-methylpropan-2-yl)oxy]-18-oxooctadecanoyl]amino]-5-oxopentanoyl]amino]ethoxy]ethoxy]-4-oxopentoxy]ethoxy]acetic acid
CID 152960114
2-[2-[2-[[11-(11,11-dimethyl-8-oxo-10-propan-2-yldodecyl)sulfanyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-6-oxoundecanoyl]amino]ethoxy]ethoxy]acetic acid
CID 162115574
16-[[(2S)-5-[2-[2-[2-[2-[2-[2-[2-[(2-bromoacetyl)amino]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-1-[(2-methylpropan-2-yl)oxy]-1,5-dioxopentan-2-yl]amino]-16-oxohexadecanoic acid
CID 121439554
tert-butyl 18-[[(2S)-1-[(2-methylpropan-2-yl)oxy]-1,5-dioxo-8-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]octan-2-yl]amino]-18-oxooctadecanoate;methane;methanol;2-[2-[2-[[2-[2-[(7S)-8-[(2-methylpropan-2-yl)oxy]-7-[[18-[(2-methylpropan-2-yl)oxy]-18-oxooctadecanoyl]amino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid;sulfane
CID 161373014
2-[2-[2-[[2-[2-[2-[[(4S)-5-[(2-methylpropan-2-yl)oxy]-4-[[20-[(2-methylpropan-2-yl)oxy]-20-oxoicosanoyl]amino]-5-oxopentanoyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid
CID 86644529
14-[[(1S)-1-carboxy-7-[2-[2-[2-[2-[(4R)-4-carboxy-2,7-dioxooctoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]-4-oxoheptyl]amino]-14-oxotetradecanoic acid
CID 157067449
(20R)-23-[2-[2-[5-[2-(2,2-dimethoxyethoxy)ethoxy]-2-oxopentoxy]ethoxy]ethylamino]-20-[(2-methylpropan-2-yl)oxycarbonyl]-18,23-dioxotricosanoic acid
CID 159761101
(2R,5R)-8-amino-5-[4-[[2-[2-[5-[2-[2-[[(4S)-4-carboxy-4-(13-carboxytridecanoylamino)butanoyl]amino]ethoxy]ethoxy]-4-oxopentoxy]ethoxy]acetyl]amino]butyl]-2-[4-[[2-[2-[2-[[2-[2-[(7S)-7-carboxy-7-(13-carboxytridecanoylamino)-4-oxoheptoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]butyl]-8-methyl-4,7-dioxononanoic acid
CID 162259040
18-[[(1S)-1-carboxy-7-[2-[2-[2-[2-[(4R)-4-carboxy-7-[[(1S)-1-carboxy-4-[[(5S)-5-methyl-6-oxoheptyl]amino]-4-oxobutyl]amino]-2,7-dioxoheptoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]-4-oxoheptyl]amino]-18-oxooctadecanoic acid
CID 148761724
18-[[(1S)-1-carboxy-4-oxo-7-[2-[2-oxo-2-[2-[2-[2-oxo-5-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]pentoxy]ethoxy]ethylamino]ethoxy]ethoxy]heptyl]amino]-18-oxooctadecanoic acid
CID 165058045
14-[[(1S)-1-carboxy-7-[2-[2-[2-[2-[2-[2-[[2-[(2R,5S)-5-carboxy-6-hydroxy-2-methyl-3-oxohexyl]sulfanylacetyl]amino]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]-4-oxoheptyl]amino]-14-oxotetradecanoic acid
CID 159527313

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid?
The IUPAC name of carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid (CID 159704701) is carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid.
What is the SMILES notation for carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid?
The canonical SMILES for carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid is CC(C)(C)OC(=O)C(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)NC(=O)CCCCCCCSCCCCCCCC(=O)C(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCCOCCOCCOCCCCC(=O)COCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NC(CCC(=O)CCCOCCOCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NC(CSCCCCCCCC(=O)NCCOCCOCC(=O)CC(CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.O=C=O.
What is the InChIKey of carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid?
The InChIKey is MYBGFJOJZLGVDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H80N2O15S.C45H80N2O14S.C45H81NO11S.C42H75N3O15S.2C36H64N2O12S.CO2/c1-43(2,3)60-40(53)36(23-22-34(48)19-14-16-24-56-26-28-58-29-27-57-25-17-15-20-35(49)31-59-32-39(51)52)46-38(50)21-13-11-10-12-18-30-63-33-37(41(54)61-44(4,5)6)47-42(55)62-45(7,8)9;1-43(2,3)59-40(53)36(24-22-34(48)19-14-16-26-56-28-30-58-31-29-57-27-17-15-20-35(49)23-25-39(51)52)46-38(50)21-13-11-10-12-18-32-62-33-37(41(54)60-44(4,5)6)47-42(55)61-45(7,8)9;1-44(2,3)40(49)23-13-9-7-11-19-35-58-36-20-12-8-10-14-24-41(50)46-39(43(53)57-45(4,5)6)27-25-37(47)21-15-17-29-54-31-33-56-34-32-55-30-18-16-22-38(48)26-28-42(51)52;1-40(2,3)58-37(51)32(19-18-31(46)16-15-21-54-23-25-56-28-35(48)43-20-22-55-24-26-57-29-36(49)50)44-34(47)17-13-11-10-12-14-27-61-30-33(38(52)59-41(4,5)6)45-39(53)60-42(7,8)9;1-34(2,3)48-31(43)27(19-18-26(39)16-15-20-46-21-22-47-24-30(41)42)37-29(40)17-13-11-10-12-14-23-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;1-34(2,3)48-31(43)26(16-17-30(41)42)23-27(39)24-47-21-20-46-19-18-37-29(40)15-13-11-10-12-14-22-51-25-28(32(44)49-35(4,5)6)38-33(45)50-36(7,8)9;2-1-3/h36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);36-37H,10-33H2,1-9H3,(H,46,50)(H,47,55)(H,51,52);39H,7-36H2,1-6H3,(H,46,50)(H,51,52);32-33H,10-30H2,1-9H3,(H,43,48)(H,44,47)(H,45,53)(H,49,50);27-28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);26,28H,10-25H2,1-9H3,(H,37,40)(H,38,45)(H,41,42);.
What are the key properties of carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid?
carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid has a molecular weight of 5106.71 g/mol, XLogP of 37.37, 199 rotatable bonds, 18 hydrogen bond donors, and 81 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;8-[2-[2-[8-[8-(9,9-dimethyl-8-oxodecyl)sulfanyloctanoylamino]-9-[(2-methylpropan-2-yl)oxy]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;4-[(2-methylpropan-2-yl)oxycarbonyl]-7-[2-[2-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]ethoxy]ethoxy]-6-oxoheptanoic acid;2-[6-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-2-oxohexoxy]acetic acid;8-[2-[2-[9-[(2-methylpropan-2-yl)oxy]-8-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-5,9-dioxononoxy]ethoxy]ethoxy]-4-oxooctanoic acid;2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetic acid;2-[2-[2-[[2-[2-[8-[(2-methylpropan-2-yl)oxy]-7-[8-[3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyloctanoylamino]-4,8-dioxooctoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetic acid is sourced from PubChem (CID 159704701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).