Chem
J-GLOBAL ID：200907037404040155
Nikkaji number：J1.050.936J
2,2′-[26,28-Bis(diphenylphosphinylmethoxy)-5,11,17,23-tetra-tert-butylpentacyclo[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-diylbis(oxy)]bis(acetic acid tert-butyl) ester
2,2′-[26,28-ビス(ジフェニルホスフィニルメトキシ)-5,11,17,23-テトラ-tert-ブチルペンタシクロ[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-ジイルビス(オキシ)]ビス(酢酸tert-ブチル)
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： C82H98O10P2
Molecular formula furigana： C82-H98-O10-P2
Molecular weight： 1305.624
InChI：
InChI=1S/C82H98O10P2/c1-77(2,3)63-43-55-39-59-47-65(79(7,8)9)49-61(75(59)89-53-93(85,67-31-23-19-24-32-67)68-33-25-20-26-34-68)41-57-45-64(78(4,5)6)46-58(74(57)88-52-72(84)92-82(16,17)18)42-62-50-66(80(10,11)12)48-60(40-56(44-63)73(55)87-51-71(83)91-81(13,14)15)76(62)90-54-94(86,69-35-27-21-28-36-69)70-37-29-22-30-38-70/h19-38,43-50H,39-42,51-54H2,1-18H3
InChI key：
XBBZAFRDRVGNNI-UHFFFAOYSA-N
SMILES：
CC(C)(C)OC(=O)COc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc1cc(c2)C(C)(C)C)c5OCP(=O)(c1ccccc1)c1ccccc1)C(C)(C)C)c4OCC(=O)OC(C)(C)C)C(C)(C)C)c3OCP(=O)(c1ccccc1)c1ccccc1)C(C)(C)C
Systematic name (3)：
- 2,2′-[26,28-ビス(ジフェニルホスフィニルメトキシ)-5,11,17,23-テトラ-tert-ブチルペンタシクロ[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-ジイルビス(オキシ)]ビス(酢酸tert-ブチル)
- tert-ブチル 2-({27-[2-(tert-ブトキシ)-2-オキソエトキシ]-5,11,17,23-テトラ-tert-ブチル-26,28-ビス[(ジフェニルホスホロソ)メトキシ]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-イル}オキシ)アセタート
- tert-butyl 2-({27-[2-(tert-butoxy)-2-oxoethoxy]-5,11,17,23-tetra-tert-butyl-26,28-bis[(diphenylphosphoroso)methoxy]pentacyclo[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-25-yl}oxy)acetate
- 2,2′-[26,28-Bis(diphenylphosphinylmethoxy)-5,11,17,23-tetra-tert-butylpentacyclo[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-diylbis(oxy)]bis(acetic acid tert-butyl) ester
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