sodium [5-[2-(2-hexyldecanoyloxy)-1-oxidanyl-ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] hydrogen phosphate

Systemtic Name: sodium [5-[2-(2-hexyldecanoyloxy)-1-oxidanyl-ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] hydrogen phosphate Openeye Name: sodium [5-[2-(2-hexyldecanoyloxy)-1-hydroxy-ethyl]-2-hydroxy-4-oxo-3-furyl] hydrogen phosphate CAS Name: sodium [5-[2-(2-hexyl-1-oxodecoxy)-1-hydroxyethyl]-2-hydroxy-4-oxo-3-furanyl] hydrogen phosphate IUPAC Name: sodium [5-[2-(2-hexyldecanoyloxy)-1-hydroxyethyl]-2-hydroxy-4-oxofuran-3-yl] hydrogen phosphate Traditional Name: sodium [5-[2-(2-hexyldecanoyloxy)-1-hydroxy-ethyl]-2-hydroxy-4-keto-3-furyl] hydrogen phosphate Formula: C22H38NaO10P MolecularWeight: 516.494651

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)C(=O)OCC(C1C(=O)C(=C(O1)O)OP(=O)(O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCC(CCCCCC)C(=O)OCC(C1C(=O)C(=C(O1)O)OP(=O)(O)[O-])O.[Na+]

InChI

InChI=1S/C22H39O10P.Na/c1-3-5-7-9-10-12-14-16(13-11-8-6-4-2)21(25)30-15-17(23)19-18(24)20(22(26)31-19)32-33(27,28)29;/h16-17,19,23,26H,3-15H2,1-2H3,(H2,27,28,29);/q;+1/p-1