(5E,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-4-oxidanyl-pentadeca-5,9,13-triene-1-sulfonic acid

Systemtic Name: (5E,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-4-oxidanyl-pentadeca-5,9,13-triene-1-sulfonic acid Openeye Name: (5E,9E)-1-diethoxyphosphoryl-4-hydroxy-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid CAS Name: (5E,9E)-1-diethoxyphosphoryl-4-hydroxy-6,10,14-trimethyl-1-pentadeca-5,9,13-trienesulfonic acid IUPAC Name: (5E,9E)-1-diethoxyphosphoryl-4-hydroxy-6,10,14-trimethylpentadeca-5,9,13-triene-1-sulfonic acid Traditional Name: (5E,9E)-1-diethoxyphosphoryl-4-hydroxy-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid Formula: C22H41O7PS MolecularWeight: 480.595501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCC(C=C(C)CCC=C(C)CCC=C(C)C)O)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CCC(/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)O)S(=O)(=O)O)OCC

InChI

InChI=1S/C22H41O7PS/c1-7-28-30(24,29-8-2)22(31(25,26)27)16-15-21(23)17-20(6)14-10-13-19(5)12-9-11-18(3)4/h11,13,17,21-23H,7-10,12,14-16H2,1-6H3,(H,25,26,27)/b19-13+,20-17+