Chem
J-GLOBAL ID：200907029792787469   Nikkaji number：J883.866F

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

2,4-ビス[4-[(E)-2-[3,4-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/c1-5-9-13-17-29-63-47-27-25-39(37-49(47)65-31-19-15-11-7-3)21-23-41-33-43(57)51(44(58)34-41)53-55(61)54(56(53)62)52-45(59)35-42(36-46(52)60)24-22-40-26-28-48(64-30-18-14-10-6-2)50(38-40)66-32-20-16-12-8-4/h21-28,33-38,53,57-61H,5-20,29-32H2,1-4H3/b23-21+,24-22+
InChI key： HFLHCDPNPLGZSZ-MBALSZOMSA-N
SMILES： CCCCCCOc1ccc(/C=C/c2cc(O)c(C3C(=C(C3=O)c3c(O)cc(/C=C/c4ccc(OCCCCCC)c(OCCCCCC)c4)cc3O)O)c(O)c2)cc1OCCCCCC
Systematic name  (3)：
  • 2,4-ビス[4-[(E)-2-[3,4-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-[3,4-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-[3,4-bis(hexyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl})-3-hydroxycyclobut-2-en-1-one
Other name (1)：
  • 2,4-Bis[4-[(E)-2-[3,4-bis(hexyloxy)phenyl]ethenyl]-2,6-dihydroxyphenyl]-3-hydroxy-2-cyclobuten-1-one
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