[2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(Z)-oct-2-enyl]-5-oxidanylidene-cyclopentylidene]methyl]oxiran-2-yl]butanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(Z)-oct-2-enyl]-5-oxidanylidene-cyclopentylidene]methyl]oxiran-2-yl]butanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(Z)-oct-2-enyl]-5-oxo-cyclopentylidene]methyl]oxiran-2-yl]butanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(Z)-oct-2-enyl]-5-oxocyclopentylidene]methyl]-2-oxiranyl]-1-oxobutoxy]-3-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(Z)-oct-2-enyl]-5-oxocyclopentylidene]methyl]oxiran-2-yl]butanoyloxy]-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-[4-[(2R,3R)-3-[(E)-[(2R,3R)-3-[tert-butyl(diphenyl)silyl]oxy-5-keto-2-[(Z)-oct-2-enyl]cyclopentylidene]methyl]oxiran-2-yl]butanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C60H96NO11PSi MolecularWeight: 1066.463601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC1C(O1)C=C2C(C(CC2=O)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)CC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC[C@@H]1[C@H](O1)/C=C/2\[C@H]([C@@H](CC2=O)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)C/C=C\CCCCC

InChI

InChI=1S/C60H96NO11PSi/c1-9-11-13-15-17-18-19-20-21-22-23-25-33-41-58(63)67-47-49(48-69-73(65,66)68-44-43-61(6,7)8)70-59(64)42-34-40-55-57(71-55)45-53-52(39-32-24-16-14-12-10-2)56(46-54(53)62)72-74(60(3,4)5,50-35-28-26-29-36-50)51-37-30-27-31-38-51/h24,26-32,35-38,45,49,52,55-57H,9-23,25,33-34,39-44,46-48H2,1-8H3/b32-24-,53-45+/t49?,52-,55-,56-,57-/m1/s1