[3,4-bis(oxidanyl)-6-oxidanylidene-1-(trimethylazaniumyl)tricosan-2-yl] hydrogen phosphate

Systemtic Name: [3,4-bis(oxidanyl)-6-oxidanylidene-1-(trimethylazaniumyl)tricosan-2-yl] hydrogen phosphate Openeye Name: [2,3-dihydroxy-5-oxo-1-[(trimethylammonio)methyl]docosyl] hydrogen phosphate CAS Name: [3,4-dihydroxy-6-oxo-1-(trimethylammonio)tricosan-2-yl] hydrogen phosphate IUPAC Name: [3,4-dihydroxy-6-oxo-1-(trimethylazaniumyl)tricosan-2-yl] hydrogen phosphate Traditional Name: [2,3-dihydroxy-5-keto-1-[(trimethylammonio)methyl]docosyl] hydrogen phosphate Formula: C26H54NO7P MolecularWeight: 523.683221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)CC(C(C(C[N+](C)(C)C)OP(=O)(O)[O-])O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)CC(C(C(C[N+](C)(C)C)OP(=O)(O)[O-])O)O

InChI

InChI=1S/C26H54NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(28)21-24(29)26(30)25(22-27(2,3)4)34-35(31,32)33/h24-26,29-30H,5-22H2,1-4H3,(H-,31,32,33)