Chem
J-GLOBAL ID：200907096643475259
Nikkaji number：J1.722.945A
5,17-Dibromo-25,26,27,28-tetrakis(benzyloxy)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-dodecene
25,26,27,28-テトラキス(ベンジルオキシ)-5,17-ジブロモペンタシクロ[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
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： C56H46Br2O4
Molecular formula furigana： C56-H46-BR2-O4
Molecular weight： 942.788
InChI：
InChI=1S/C56H46Br2O4/c57-51-31-47-27-43-23-13-24-44(53(43)59-35-39-15-5-1-6-16-39)28-48-32-52(58)34-50(56(48)62-38-42-21-11-4-12-22-42)30-46-26-14-25-45(54(46)60-36-40-17-7-2-8-18-40)29-49(33-51)55(47)61-37-41-19-9-3-10-20-41/h1-26,31-34H,27-30,35-38H2
InChI key：
UIWSABBSCNMHLK-UHFFFAOYSA-N
SMILES：
Brc1cc2Cc3cccc(Cc4cc(Br)cc(Cc5cccc(Cc(c1)c2OCc1ccccc1)c5OCc1ccccc1)c4OCc1ccccc1)c3OCc1ccccc1
Systematic name (3)：
- 5,17-ジブロモ-25,26,27,28-テトラキス(ベンジルオキシ)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
- 25,26,27,28-テトラキス(ベンジルオキシ)-5,17-ジブロモペンタシクロ[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
- 25,26,27,28-tetrakis(benzyloxy)-5,17-dibromopentacyclo[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
- 5,17-Dibromo-25,26,27,28-tetrakis(benzyloxy)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-dodecene
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