(5Z,9E)-1-[bis(1-propanoyloxyethoxy)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid

Systemtic Name: (5Z,9E)-1-[bis(1-propanoyloxyethoxy)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid Openeye Name: (5Z,9E)-1-[bis(1-propanoyloxyethoxy)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid CAS Name: (5Z,9E)-1-[bis[1-(1-oxopropoxy)ethoxy]phosphoryl]-6,10,14-trimethyl-1-pentadeca-5,9,13-trienesulfonic acid IUPAC Name: (5Z,9E)-1-[bis(1-propanoyloxyethoxy)phosphoryl]-6,10,14-trimethylpentadeca-5,9,13-triene-1-sulfonic acid Traditional Name: (5Z,9E)-1-[bis(1-propionyloxyethoxy)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid Formula: C28H49O10PS MolecularWeight: 608.721421

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)OP(=O)(C(CCCC=C(C)CCC=C(C)CCC=C(C)C)S(=O)(=O)O)OC(C)OC(=O)CC

Isomeric SMILES

CCC(=O)OC(C)OP(=O)(C(CCC/C=C(/C)\CC/C=C(\C)/CCC=C(C)C)S(=O)(=O)O)OC(C)OC(=O)CC

InChI

InChI=1S/C28H49O10PS/c1-9-26(29)35-24(7)37-39(31,38-25(8)36-27(30)10-2)28(40(32,33)34)20-12-11-16-22(5)18-14-19-23(6)17-13-15-21(3)4/h15-16,19,24-25,28H,9-14,17-18,20H2,1-8H3,(H,32,33,34)/b22-16-,23-19+