[5-(hexadecanoylamino)-4-methoxy-1-(trimethylazaniumyl)pentan-2-yl] hydrogen phosphate

Systemtic Name: [5-(hexadecanoylamino)-4-methoxy-1-(trimethylazaniumyl)pentan-2-yl] hydrogen phosphate Openeye Name: [4-(hexadecanoylamino)-3-methoxy-1-[(trimethylammonio)methyl]butyl] hydrogen phosphate CAS Name: [4-methoxy-5-(1-oxohexadecylamino)-1-(trimethylammonio)pentan-2-yl] hydrogen phosphate IUPAC Name: [5-(hexadecanoylamino)-4-methoxy-1-(trimethylazaniumyl)pentan-2-yl] hydrogen phosphate Traditional Name: [3-methoxy-4-palmitamido-1-[(trimethylammonio)methyl]butyl] hydrogen phosphate Formula: C25H53N2O6P MolecularWeight: 508.671881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCC(CC(C[N+](C)(C)C)OP(=O)(O)[O-])OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCC(CC(C[N+](C)(C)C)OP(=O)(O)[O-])OC

InChI

InChI=1S/C25H53N2O6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)26-21-23(32-5)20-24(22-27(2,3)4)33-34(29,30)31/h23-24H,6-22H2,1-5H3,(H2-,26,28,29,30,31)