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Hexaprenylhydroquinone Sulfate monosodium salt
[CAS# 113267-17-7]

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Identification
Name Hexaprenylhydroquinone Sulfate monosodium salt
Synonyms Sodium 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-Hexamethyltetracosa-2,6,10,14,18,22-Hexaenyl]-4-Sulfooxy-Phenolate; Sodium 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-Hexamethyltetracosa-2,6,10,14,18,22-Hexaenyl]-4-Sulfoxy-Phenolate; Hpqs
Molecular Structure CAS#: 113267-17-7, Hexaprenylhydroquinone Sulfate monosodium salt
Molecular Formula C36H53NaO5S
Molecular Weight 620.86
CAS Registry Number 113267-17-7
SMILES C1=C(C(=CC=C1[O-])O[S](=O)(=O)O)C\C=C(\CC\C=C(\CC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)C)C)C)C)C.[Na+]
InChI 1S/C36H54O5S.Na/c1-28(2)13-8-14-29(3)15-9-16-30(4)17-10-18-31(5)19-11-20-32(6)21-12-22-33(7)23-24-34-27-35(37)25-26-36(34)41-42(38,39)40;/h13,15,17,19,21,23,25-27,37H,8-12,14,16,18,20,22,24H2,1-7H3,(H,38,39,40);/q;+1/p-1/b29-15+,30-17+,31-19+,32-21+,33-23+;
InChIKey LVNMAOZVGKMQHA-YLVKWKSSSA-M
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