tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)

C207H324N32Na24O156S18-10 — CID 162024941

IUPACtetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)
SMILESC=C(CCC(=O)N(CCCCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCCO[C@@H]1OC(C(=O)[O-])[C@@H](O[C@H]2OC([CH2-])[C@@H](O)[C@H](O)C2[NH-])[C@H](O)C1O.C=C(CCC(=O)N(CCOCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCO[C@H]1OC([CH2-])[C@@H](O)[CH-]C1[NH-].C=C[C@@H]1O[C@H](C=C)[C@@H]2C(=O)N(CCCCCN(Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(=O)CCC(=C)NCCOCCO[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])C(=O)[C@@H]21.O=C=O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.[CH2-]C1O[C@H](O[C@@H]2[CH-]O[C@@H](CCCOCCNC(=O)CCC(=O)N(CCOCCN3C(=O)[C@@H]4[C@H](C3=O)[C@H](CC)O[C@@H]4CC)Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(O)[CH-]2)C([NH-])[C@@H](O)[C@@H]1O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/C56H88N8O26.C53H82N8O24.C49H74N8O20.C48H75N8O20.CO2.24Na.10H2O4S.8O3S/c1-6-30-33-34(31(7-2)86-30)50(75)64(49(33)74)16-10-8-9-15-62(24-29-25-63(61-60-29)17-21-81-22-23-83-56-44(73)42(71)46(48(90-56)52(78)79)88-54-36(58)40(69)38(67)28(5)85-54)32(65)13-12-26(3)59-14-20-80-18-11-19-82-55-43(72)41(70)45(47(89-55)51(76)77)87-53-35(57)39(68)37(66)27(4)84-53;1-5-31-36-37(32(6-2)83-31)49(72)61(48(36)71)14-19-76-17-12-59(35(64)10-9-34(63)56-11-16-75-15-7-8-33-30(62)22-29(25-79-33)82-51-38(54)42(67)40(65)26(3)80-51)23-28-24-60(58-57-28)13-18-77-20-21-78-53-45(70)44(69)46(47(85-53)50(73)74)84-52-39(55)43(68)41(66)27(4)81-52;1-6-29-32-33(30(7-2)75-29)45(66)57(44(32)65)15-10-8-9-14-55(31(58)12-11-25(3)52-13-17-69-19-21-71-47-34(50)38(61)36(59)26(4)73-47)23-28-24-56(54-53-28)16-18-70-20-22-72-49-41(64)40(63)42(43(77-49)46(67)68)76-48-35(51)39(62)37(60)27(5)74-48;1-6-31-34-35(32(7-2)74-31)44(64)56(43(34)63)13-17-68-15-11-54(33(58)9-8-25(3)51-10-14-67-18-20-70-46-29(49)22-30(57)26(4)72-46)23-28-24-55(53-52-28)12-16-69-19-21-71-48-40(62)39(61)41(42(76-48)45(65)66)75-47-36(50)38(60)37(59)27(5)73-47;2-1-3;;;;;;;;;;;;;;;;;;;;;;;;;10*1-5(2,3)4;8*1-4(2)3/h25,27-28,30-31,33-48,53-59,66-73H,3-24H2,1-2H3,(H,76,77)(H,78,79);22,24-27,29-33,36-47,51-55,62,65-70H,3-21,23H2,1-2H3,(H,56,63)(H,73,74);6-7,24,26-27,29-30,32-43,47-52,59-64H,1-5,8-23H2,(H,67,68);22,24,26-27,29-32,34-42,46-51,57,59-62H,3-21,23H2,1-2H3,(H,65,66);;;;;;;;;;;;;;;;;;;;;;;;;;10*(H2,1,2,3,4);;;;;;;;/q-4;-6;-4;-5;;24*+1;;;;;;;;;;;;;;;;;;/p-15/t27?,28?,30-,31+,33+,34-,35?,36?,37-,38-,39-,40-,41-,42-,43?,44?,45+,46+,47?,48?,53-,54-,55-,56-;26?,27?,29-,30?,31-,32+,33-,36+,37-,38?,39?,40+,41+,42+,43+,44+,45?,46-,47?,51+,52+,53+;26?,27?,29-,30+,32+,33-,34?,35?,36-,37-,38-,39-,40-,41?,42+,43?,47+,48-,49-;26?,27?,29?,30-,31-,32+,34+,35-,36?,37+,38+,39+,40?,41-,42?,46-,47+,48+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m1010.........................................../s1
InChIKeySGWSCRKMTHHZNL-RJQTZIPDSA-A
MW6885.90 g/mol
LogP-108.53
Rot. Bonds129

About tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)

tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) (PubChem CID 162024941) has the molecular formula C207H324N32Na24O156S18-10 and a molecular weight of 6885.90 g/mol. Its IUPAC name is tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide).

Molecular Properties

Compound Nametetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)
PubChem CID162024941
Molecular FormulaC207H324N32Na24O156S18-10
Molecular Weight6885.90 g/mol
Exact Mass6881.10
IUPAC Nametetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)
SMILESC=C(CCC(=O)N(CCCCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCCO[C@@H]1OC(C(=O)[O-])[C@@H](O[C@H]2OC([CH2-])[C@@H](O)[C@H](O)C2[NH-])[C@H](O)C1O.C=C(CCC(=O)N(CCOCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCO[C@H]1OC([CH2-])[C@@H](O)[CH-]C1[NH-].C=C[C@@H]1O[C@H](C=C)[C@@H]2C(=O)N(CCCCCN(Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(=O)CCC(=C)NCCOCCO[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])C(=O)[C@@H]21.O=C=O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.[CH2-]C1O[C@H](O[C@@H]2[CH-]O[C@@H](CCCOCCNC(=O)CCC(=O)N(CCOCCN3C(=O)[C@@H]4[C@H](C3=O)[C@H](CC)O[C@@H]4CC)Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(O)[CH-]2)C([NH-])[C@@H](O)[C@@H]1O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/C56H88N8O26.C53H82N8O24.C49H74N8O20.C48H75N8O20.CO2.24Na.10H2O4S.8O3S/c1-6-30-33-34(31(7-2)86-30)50(75)64(49(33)74)16-10-8-9-15-62(24-29-25-63(61-60-29)17-21-81-22-23-83-56-44(73)42(71)46(48(90-56)52(78)79)88-54-36(58)40(69)38(67)28(5)85-54)32(65)13-12-26(3)59-14-20-80-18-11-19-82-55-43(72)41(70)45(47(89-55)51(76)77)87-53-35(57)39(68)37(66)27(4)84-53;1-5-31-36-37(32(6-2)83-31)49(72)61(48(36)71)14-19-76-17-12-59(35(64)10-9-34(63)56-11-16-75-15-7-8-33-30(62)22-29(25-79-33)82-51-38(54)42(67)40(65)26(3)80-51)23-28-24-60(58-57-28)13-18-77-20-21-78-53-45(70)44(69)46(47(85-53)50(73)74)84-52-39(55)43(68)41(66)27(4)81-52;1-6-29-32-33(30(7-2)75-29)45(66)57(44(32)65)15-10-8-9-14-55(31(58)12-11-25(3)52-13-17-69-19-21-71-47-34(50)38(61)36(59)26(4)73-47)23-28-24-56(54-53-28)16-18-70-20-22-72-49-41(64)40(63)42(43(77-49)46(67)68)76-48-35(51)39(62)37(60)27(5)74-48;1-6-31-34-35(32(7-2)74-31)44(64)56(43(34)63)13-17-68-15-11-54(33(58)9-8-25(3)51-10-14-67-18-20-70-46-29(49)22-30(57)26(4)72-46)23-28-24-55(53-52-28)12-16-69-19-21-71-48-40(62)39(61)41(42(76-48)45(65)66)75-47-36(50)38(60)37(59)27(5)73-47;2-1-3;;;;;;;;;;;;;;;;;;;;;;;;;10*1-5(2,3)4;8*1-4(2)3/h25,27-28,30-31,33-48,53-59,66-73H,3-24H2,1-2H3,(H,76,77)(H,78,79);22,24-27,29-33,36-47,51-55,62,65-70H,3-21,23H2,1-2H3,(H,56,63)(H,73,74);6-7,24,26-27,29-30,32-43,47-52,59-64H,1-5,8-23H2,(H,67,68);22,24,26-27,29-32,34-42,46-51,57,59-62H,3-21,23H2,1-2H3,(H,65,66);;;;;;;;;;;;;;;;;;;;;;;;;;10*(H2,1,2,3,4);;;;;;;;/q-4;-6;-4;-5;;24*+1;;;;;;;;;;;;;;;;;;/p-15/t27?,28?,30-,31+,33+,34-,35?,36?,37-,38-,39-,40-,41-,42-,43?,44?,45+,46+,47?,48?,53-,54-,55-,56-;26?,27?,29-,30?,31-,32+,33-,36+,37-,38?,39?,40+,41+,42+,43+,44+,45?,46-,47?,51+,52+,53+;26?,27?,29-,30+,32+,33-,34?,35?,36-,37-,38-,39-,40-,41?,42+,43?,47+,48-,49-;26?,27?,29?,30-,31-,32+,34+,35-,36?,37+,38+,39+,40?,41-,42?,46-,47+,48+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m1010.........................................../s1
InChIKeySGWSCRKMTHHZNL-RJQTZIPDSA-A
XLogP-108.53
TPSA2932.37 Ų
H-Bond Donors40
H-Bond Acceptors161
Rotatable Bonds129
Heavy Atoms437
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006885.90
LogP ≤ 5-108.53
H-Bond Donors ≤ 540
H-Bond Acceptors ≤ 10161

Analyze tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) with MolForge

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Frequently Asked Questions

What is the IUPAC name of tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)?
The IUPAC name of tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) (CID 162024941) is tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide).
What is the SMILES notation for tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)?
The canonical SMILES for tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) is C=C(CCC(=O)N(CCCCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCCO[C@@H]1OC(C(=O)[O-])[C@@H](O[C@H]2OC([CH2-])[C@@H](O)[C@H](O)C2[NH-])[C@H](O)C1O.C=C(CCC(=O)N(CCOCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CC)O[C@@H]2CC)Cc1cn(CCOCCO[C@@H]2OC(C(=O)[O-])[C@@H](O[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])[C@H](O)C2O)nn1)NCCOCCO[C@H]1OC([CH2-])[C@@H](O)[CH-]C1[NH-].C=C[C@@H]1O[C@H](C=C)[C@@H]2C(=O)N(CCCCCN(Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(=O)CCC(=C)NCCOCCO[C@H]3OC([CH2-])[C@@H](O)[C@H](O)C3[NH-])C(=O)[C@@H]21.O=C=O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.[CH2-]C1O[C@H](O[C@@H]2[CH-]O[C@@H](CCCOCCNC(=O)CCC(=O)N(CCOCCN3C(=O)[C@@H]4[C@H](C3=O)[C@H](CC)O[C@@H]4CC)Cc3cn(CCOCCO[C@@H]4OC(C(=O)[O-])[C@@H](O[C@H]5OC([CH2-])[C@@H](O)[C@H](O)C5[NH-])[C@H](O)C4O)nn3)C(O)[CH-]2)C([NH-])[C@@H](O)[C@@H]1O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].
What is the InChIKey of tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)?
The InChIKey is SGWSCRKMTHHZNL-RJQTZIPDSA-A. The full InChI is InChI=1S/C56H88N8O26.C53H82N8O24.C49H74N8O20.C48H75N8O20.CO2.24Na.10H2O4S.8O3S/c1-6-30-33-34(31(7-2)86-30)50(75)64(49(33)74)16-10-8-9-15-62(24-29-25-63(61-60-29)17-21-81-22-23-83-56-44(73)42(71)46(48(90-56)52(78)79)88-54-36(58)40(69)38(67)28(5)85-54)32(65)13-12-26(3)59-14-20-80-18-11-19-82-55-43(72)41(70)45(47(89-55)51(76)77)87-53-35(57)39(68)37(66)27(4)84-53;1-5-31-36-37(32(6-2)83-31)49(72)61(48(36)71)14-19-76-17-12-59(35(64)10-9-34(63)56-11-16-75-15-7-8-33-30(62)22-29(25-79-33)82-51-38(54)42(67)40(65)26(3)80-51)23-28-24-60(58-57-28)13-18-77-20-21-78-53-45(70)44(69)46(47(85-53)50(73)74)84-52-39(55)43(68)41(66)27(4)81-52;1-6-29-32-33(30(7-2)75-29)45(66)57(44(32)65)15-10-8-9-14-55(31(58)12-11-25(3)52-13-17-69-19-21-71-47-34(50)38(61)36(59)26(4)73-47)23-28-24-56(54-53-28)16-18-70-20-22-72-49-41(64)40(63)42(43(77-49)46(67)68)76-48-35(51)39(62)37(60)27(5)74-48;1-6-31-34-35(32(7-2)74-31)44(64)56(43(34)63)13-17-68-15-11-54(33(58)9-8-25(3)51-10-14-67-18-20-70-46-29(49)22-30(57)26(4)72-46)23-28-24-55(53-52-28)12-16-69-19-21-71-48-40(62)39(61)41(42(76-48)45(65)66)75-47-36(50)38(60)37(59)27(5)73-47;2-1-3;;;;;;;;;;;;;;;;;;;;;;;;;10*1-5(2,3)4;8*1-4(2)3/h25,27-28,30-31,33-48,53-59,66-73H,3-24H2,1-2H3,(H,76,77)(H,78,79);22,24-27,29-33,36-47,51-55,62,65-70H,3-21,23H2,1-2H3,(H,56,63)(H,73,74);6-7,24,26-27,29-30,32-43,47-52,59-64H,1-5,8-23H2,(H,67,68);22,24,26-27,29-32,34-42,46-51,57,59-62H,3-21,23H2,1-2H3,(H,65,66);;;;;;;;;;;;;;;;;;;;;;;;;;10*(H2,1,2,3,4);;;;;;;;/q-4;-6;-4;-5;;24*+1;;;;;;;;;;;;;;;;;;/p-15/t27?,28?,30-,31+,33+,34-,35?,36?,37-,38-,39-,40-,41-,42-,43?,44?,45+,46+,47?,48?,53-,54-,55-,56-;26?,27?,29-,30?,31-,32+,33-,36+,37-,38?,39?,40+,41+,42+,43+,44+,45?,46-,47?,51+,52+,53+;26?,27?,29-,30+,32+,33-,34?,35?,36-,37-,38-,39-,40-,41?,42+,43?,47+,48-,49-;26?,27?,29?,30-,31-,32+,34+,35-,36?,37+,38+,39+,40?,41-,42?,46-,47+,48+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m1010.........................................../s1.
What are the key properties of tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide)?
tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) has a molecular weight of 6885.90 g/mol, XLogP of -108.53, 129 rotatable bonds, 40 hydrogen bond donors, and 161 hydrogen bond acceptors.
Where does this data come from?
All data for tetracosasodium;(3S,4R,6R)-6-[2-[2-[4-[[5-[(1R,3S,3aS,6aR)-1,3-bis(ethenyl)-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[4-[2-[2-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxyethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[3-[(2S,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-3-hydroxy-3,4,5,6-tetrahydro-2H-pyran-4,6-diid-2-yl]propoxy]ethylamino]-4-oxobutanoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[2-[2-[4-[[2-[2-[(1R,3S,3aS,6aR)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]ethoxy]ethyl-[4-[2-[2-[[(2S,5S)-3-azanidyl-5-hydroxy-6-methanidyl-3,4,5,6-tetrahydro-2H-pyran-4-id-2-yl]oxy]ethoxy]ethylamino]pent-4-enoyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;(3S,4R,6R)-6-[3-[2-[[5-[5-[(1S,3R,3aR,6aS)-1,3-diethyl-4,6-dioxo-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrol-5-yl]pentyl-[[1-[2-[2-[(2R,4R,5S)-5-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-6-carboxylato-3,4-dihydroxyoxan-2-yl]oxyethoxy]ethyl]triazol-4-yl]methyl]amino]-5-oxopent-1-en-2-yl]amino]ethoxy]propoxy]-3-[(2R,4R,5S)-3-azanidyl-4,5-dihydroxy-6-methanidyloxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylate;carbon dioxide;hydrogen sulfate;octakis(sulfur trioxide) is sourced from PubChem (CID 162024941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).