Chem
J-GLOBAL ID：200907005793253372   Nikkaji number：J883.867D

2,4-Bis[4-[(E)-2-[3,5-bis(hexyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl]-3-hydroxy-2-cyclobuten-1-one

2,4-ビス[4-[(E)-2-[3,5-ビス(ヘキシルオキシ)フェニル]エテニル]-2,6-ジヒドロキシフェニル]-3-ヒドロキシ-2-シクロブテン-1-オン
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： C56H72O10
Molecular formula furigana： C56-H72-O10
Molecular weight： 905.182
InChI： InChI=1S/C56H72O10/c1-5-9-13-17-25-63-43-29-39(30-44(37-43)64-26-18-14-10-6-2)21-23-41-33-47(57)51(48(58)34-41)53-55(61)54(56(53)62)52-49(59)35-42(36-50(52)60)24-22-40-31-45(65-27-19-15-11-7-3)38-46(32-40)66-28-20-16-12-8-4/h21-24,29-38,53,57-61H,5-20,25-28H2,1-4H3/b23-21+,24-22+
InChI key： FYSOSUMAJYTSFS-MBALSZOMSA-N
SMILES： CCCCCCOc1cc(OCCCCCC)cc(/C=C/c2cc(O)c(C3C(=C(C3=O)c3c(O)cc(/C=C/c4cc(OCCCCCC)cc(OCCCCCC)c4)cc3O)O)c(O)c2)c1
Systematic name  (3)：
  • 2,4-ビス[4-[(E)-2-[3,5-ビス(ヘキシルオキシ)フェニル]エテニル]-2,6-ジヒドロキシフェニル]-3-ヒドロキシ-2-シクロブテン-1-オン
  • 2,4-ビス({4-[(1E)-2-[3,5-ビス(ヘキシルオキシ)フェニル]エテニル]-2,6-ジヒドロキシフェニル})-3-ヒドロキシシクロブタ-2-エン-1-オン
  • 2,4-bis({4-[(1E)-2-[3,5-bis(hexyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl})-3-hydroxycyclobut-2-en-1-one
Other name (1)：
  • 2,4-Bis[4-[(E)-2-[3,5-bis(hexyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl]-3-hydroxy-2-cyclobuten-1-one
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