Chem
J-GLOBAL ID：200907011760516793   Nikkaji number：J709.991F

2,4-Bis[(E)-3,5-dihydroxy-4′-(decyloxy)stilben-4-yl]-1,3-dioxylato-3-cyclobutene-1,2-diium

2,4-ビス[(E)-3,5-ジヒドロキシ-4′-(デシルオキシ)スチルベン-4-イル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C50[C+]2H62O6[O-]2
Molecular formula furigana： C52-H62-O8
Molecular weight： 815.060
InChI： InChI=1S/C52H63O8/c1-3-5-7-9-11-13-15-17-31-59-41-27-23-37(24-28-41)19-21-39-33-43(53)47(44(54)34-39)49-51(57)50(52(49)58)48-45(55)35-40(36-46(48)56)22-20-38-25-29-42(30-26-38)60-32-18-16-14-12-10-8-6-4-2/h19-30,33-36H,3-18,31-32H2,1-2H3,(H5-,53,54,55,56,57,58)/q+1/p-1/b21-19+,22-20+
InChI key： PPMARPSZNPPNFX-FLFKKZLDSA-M
SMILES： CCCCCCCCCCOc1ccc(/C=C/c2cc(O)c(C3=C([O-])[C+](=[C+]3[O-])c3c(O)cc(/C=C/c4ccc(OCCCCCCCCCC)cc4)cc3O)c(O)c2)cc1
Systematic name  (3)：
  • 2,4-ビス[(E)-3,5-ジヒドロキシ-4′-(デシルオキシ)スチルベン-4-イル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
  • ビス({4-[(1E)-2-[4-(デシルオキシ)フェニル]エテニル]-2,6-ジヒドロキシフェニル})シクロブタ-1,3-ジエン-2-イウム-1-イリウム-2,4-ビス(オラート)
  • bis({4-[(1E)-2-[4-(decyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl})cyclobuta-1,3-dien-2-ium-1-ylium-2,4-bis(olate)
Other name (1)：
  • 2,4-Bis[(E)-3,5-dihydroxy-4′-(decyloxy)stilben-4-yl]-1,3-dioxylato-3-cyclobutene-1,2-diium
Thsaurus map：
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