magnesium [(E)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[(1Z,5Z,9Z,14Z)-8-ethenyl-13-ethyl-18-(2-hydroxyethylcarbamoyl)-20-(2-methoxy-2-oxidanylidene-ethyl)-3,7,12,17-tetramethyl-2,3,4,11-tetrahydroporphyrin-21,22,23,24-tetraid-2-yl]propanoate

Systemtic Name: magnesium [(E)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[(1Z,5Z,9Z,14Z)-8-ethenyl-13-ethyl-18-(2-hydroxyethylcarbamoyl)-20-(2-methoxy-2-oxidanylidene-ethyl)-3,7,12,17-tetramethyl-2,3,4,11-tetrahydroporphyrin-21,22,23,24-tetraid-2-yl]propanoate Openeye Name: magnesium [(E)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[(1Z,5Z,9Z,14Z)-13-ethyl-18-(2-hydroxyethylcarbamoyl)-20-(2-methoxy-2-oxo-ethyl)-3,7,12,17-tetramethyl-8-vinyl-2,3,4,11-tetrahydroporphyrin-21,22,23,24-tetraid-2-yl]propanoate CAS Name: magnesium 3-[(1Z,5Z,9Z,14Z)-8-ethenyl-13-ethyl-18-[(2-hydroxyethylamino)-oxomethyl]-20-(2-methoxy-2-oxoethyl)-3,7,12,17-tetramethyl-2,3,4,11-tetrahydroporphyrin-21,22,23,24-tetraid-2-yl]propanoic acid [(E)-3,7,11,15-tetramethylhexadec-2-enyl] ester IUPAC Name: magnesium [(E)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[(1Z,5Z,9Z,14Z)-8-ethenyl-13-ethyl-18-(2-hydroxyethylcarbamoyl)-20-(2-methoxy-2-oxoethyl)-3,7,12,17-tetramethyl-2,3,4,11-tetrahydroporphyrin-21,22,23,24-tetraid-2-yl]propanoate Traditional Name: magnesium 3-[(1Z,5Z,9Z,14Z)-13-ethyl-18-(2-hydroxyethylcarbamoyl)-20-(2-keto-2-methoxy-ethyl)-3,7,12,17-tetramethyl-8-vinyl-2,3,4,11-tetrahydroporphine-21,22,23,24-tetraid-2-yl]propionic acid [(E)-3,7,11,15-tetramethylhexadec-2-enyl] ester Formula: C57H81MgN5O6-2 MolecularWeight: 956.58794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2C=C3C(=C(C(=CC4C(C(C(=C(C5=C(C(=C([N-]5)C=C1[N-]2)C)C(=O)NCCO)CC(=O)OC)[N-]4)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)[N-]3)C)C=C)C.[Mg+2]

Isomeric SMILES

CCC\1=C(C2/C=C\3/C(=C(/C(=C/C4C(C(/C(=C(/C5=C(C(=C([N-]5)/C=C1\[N-]2)C)C(=O)NCCO)\CC(=O)OC)/[N-]4)CCC(=O)OC/C=C(\C)/CCCC(C)CCCC(C)CCCC(C)C)C)/[N-]3)C)C=C)C.[Mg+2]

InChI

InChI=1S/C57H82N5O6.Mg/c1-13-42-38(8)46-31-48-40(10)44(24-25-52(64)68-29-26-37(7)23-17-22-36(6)21-16-20-35(5)19-15-18-34(3)4)55(61-48)45(30-53(65)67-12)56-54(57(66)58-27-28-63)41(11)49(62-56)33-51-43(14-2)39(9)47(60-51)32-50(42)59-46;/h13,26,31-36,40,44,47-48,63H,1,14-25,27-30H2,2-12H3,(H2-,58,61,62,66);/q-3;+2/p-1/b37-26+,46-31-,50-32-,51-33-;