diazanium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]octadec-9-enedioate

Systemtic Name: diazanium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]octadec-9-enedioate Openeye Name: diammonium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]octadec-9-enedioate CAS Name: diammonium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]-9-octadecenedioate IUPAC Name: diazanium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]octadec-9-enedioate Traditional Name: diammonium magnesium (E)-2-[(7E,10E)-16-phosphonatohexadeca-7,10-dienyl]octadec-9-enedioate Formula: C34H65MgN2O7P MolecularWeight: 669.167861

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC=CCCCCCCC(CCCCCCC=CCC=CCCCCCP(=O)([O-])[O-])C(=O)[O-])CCCC(=O)[O-].[NH4+].[NH4+].[Mg+2]

Isomeric SMILES

C(CCC/C=C/CCCCCCC(CCCCCC/C=C/C/C=C/CCCCCP(=O)([O-])[O-])C(=O)[O-])CCCC(=O)[O-].[NH4+].[NH4+].[Mg+2]

InChI

InChI=1S/C34H61O7P.Mg.2H3N/c35-33(36)30-26-22-18-14-10-6-3-5-9-13-17-21-25-29-32(34(37)38)28-24-20-16-12-8-4-1-2-7-11-15-19-23-27-31-42(39,40)41;;;/h1,3-5,7,11,32H,2,6,8-10,12-31H2,(H,35,36)(H,37,38)(H2,39,40,41);;2*1H3/q;+2;;/p-2/b4-1+,5-3+,11-7+;;;