Chem
J-GLOBAL ID：200907002687423588
Nikkaji number：J1.728.521A
11,11′-Methylenebis[26,28-diethoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,27-diol]
11,11′-メチレンビス[26,28-ジエトキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,27-ジオール]
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
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
Molecular formula： C65H64O8
Molecular formula furigana： C65-H64-O8
Molecular weight： 973.219
InChI：
InChI=1S/C65H64O8/c1-5-70-62-46-19-11-23-50(62)36-54-28-40(29-55(60(54)68)37-51-24-12-20-47(63(51)71-6-2)33-43-16-9-15-42(32-46)58(43)66)27-41-30-56-38-52-25-13-21-48(64(52)72-7-3)34-44-17-10-18-45(59(44)67)35-49-22-14-26-53(65(49)73-8-4)39-57(31-41)61(56)69/h9-26,28-31,66-69H,5-8,27,32-39H2,1-4H3
InChI key：
URYJMRFUBIQRKD-UHFFFAOYSA-N
SMILES：
CCOc1c2Cc3cccc(Cc4cccc(Cc5cc(Cc6cc7Cc8cccc(Cc9cccc(Cc%10cccc(Cc(c6)c7O)c%10OCC)c9O)c8OCC)cc(Cc1ccc2)c5O)c4OCC)c3O
Systematic name (3)：
- 11,11′-メチレンビス[26,28-ジエトキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,27-ジオール]
- 11-({25,27-ジエトキシ-26,28-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-5-イル}メチル)-26,28-ジエトキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,27-ジオール
- 11-({25,27-diethoxy-26,28-dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaen-5-yl}methyl)-26,28-diethoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,27-diol
- 11,11′-Methylenebis[26,28-diethoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-25,27-diol]
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