Chem
J-GLOBAL ID:200907030112851697   Nikkaji number:J2.297.556K

2-[(R)-13-(tert-Butyldimethylsilyloxy)-13-[(2R,2′R,5R,5′R)-5′-[(1S,5S)-1,5-bis(tert-butyldimethylsilyloxy)undecyl]octahydro-2,2′-bifuran-5-yl]tridecyl]-1H-benzoimidazole

2-[(R)-13-(tert-ブチルジメチルシリルオキシ)-13-[(2R,2′R,5R,5′R)-5′-[(1S,5S)-1,5-ビス(tert-ブチルジメチルシリルオキシ)ウンデシル]オクタヒドロ-2,2′-ビフラン-5-イル]トリデシル]-1H-ベンゾイミダゾール
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: C57H108N2O5Si3
Molecular formula furigana: C57-H108-N2-O5-SI3
Molecular weight: 985.755
InChI: InChI=1S/C57H108N2O5Si3/c1-17-18-19-28-34-45(62-65(11,12)55(2,3)4)35-33-39-53(64-67(15,16)57(8,9)10)51-44-42-49(61-51)48-41-43-50(60-48)52(63-66(13,14)56(5,6)7)38-29-26-24-22-20-21-23-25-27-30-40-54-58-46-36-31-32-37-47(46)59-54/h31-32,36-37,45,48-53H,17-30,33-35,38-44H2,1-16H3,(H,58,59)/t45-,48+,49+,50+,51+,52+,53-/m0/s1
InChI key: QMNVEMALRCHZKY-NJOWKQKFSA-N
SMILES: CCCCCC[C@@H](CCC[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@@H](O1)[C@H]1CC[C@@H](O1)[C@@H](CCCCCCCCCCCCc1nc2ccccc2[nH]1)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
Systematic name  (3):
  • 2-[(R)-13-(tert-ブチルジメチルシリルオキシ)-13-[(2R,2′R,5R,5′R)-5′-[(1S,5S)-1,5-ビス(tert-ブチルジメチルシリルオキシ)ウンデシル]オクタヒドロ-2,2′-ビフラン-5-イル]トリデシル]-1H-ベンゾイミダゾール
  • 2-[(13R)-13-[(tert-ブチルジメチルシリル)オキシ]-13-[(2R,2'R,5R,5'R)-5'-[(5S,9S)-9-ヘキシル-2,2,3,3,11,11,12,12-オクタメチル-4,10-ジオキサ-3,11-ジシラトリデカン-5-イル]-[2,2'-ビオキソラン]-5-イル]トリデシル]-1H-1,3-ベンゾジアゾール
  • 2-[(13R)-13-[(tert-butyldimethylsilyl)oxy]-13-[(2R,2'R,5R,5'R)-5'-[(5S,9S)-9-hexyl-2,2,3,3,11,11,12,12-octamethyl-4,10-dioxa-3,11-disilatridecan-5-yl]-[2,2'-bioxolan]-5-yl]tridecyl]-1H-1,3-benzodiazole
Other name (1):
  • 2-[(R)-13-(tert-Butyldimethylsilyloxy)-13-[(2R,2′R,5R,5′R)-5′-[(1S,5S)-1,5-bis(tert-butyldimethylsilyloxy)undecyl]octahydro-2,2′-bifuran-5-yl]tridecyl]-1H-benzoimidazole
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