Chem
J-GLOBAL ID:200907047588600820
Nikkaji number:J2.535.536I
2,2′′,2′′′′-Trimethoxy-2′,2′′′,2′′′′′-tris(1-methyl-1H-imidazole-2-ylmethoxy)-5,5′′,5′′′′-tris[4-(4-tert-butylphenoxymethyl)-1H-1,2,3-triazole-1-yl]-5′,5′′′,5′′′′′-tri-tert-butyl(1,3′-methylene-1′,3′′-methylene-1′′,3′′′-methylene-1′′′,3′′′′-methylene-1′′′′,3′′′′′-methylene-1′′′′′,3-methylenehexabenzene)
2,2′′,2′′′′-トリメトキシ-2′,2′′′,2′′′′′-トリス(1-メチル-1H-イミダゾール-2-イルメトキシ)-5,5′′,5′′′′-トリス[4-(4-tert-ブチルフェノキシメチル)-1H-1,2,3-トリアゾール-1-イル]-5′,5′′′,5′′′′′-トリ-tert-ブチル(1,3′-メチレン-1′,3′′-メチレン-1′′,3′′′-メチレン-1′′′,3′′′′-メチレン-1′′′′,3′′′′′-メチレン-1′′′′′,3-メチレンヘキサベンゼン)
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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:
C111 H129 N15 O9
Molecular formula furigana:
C111-H129-N15-O9
Molecular weight:
1817.349
InChI:
InChI=1S/C111H129N15O9/c1-106(2,3)82-25-31-94(32-26-82)130-64-88-61-124(118-115-88)91-55-76-43-70-49-85(109(10,11)12)51-72(103(70)133-67-97-112-37-40-121(97)19)45-78-57-92(125-62-89(116-119-125)65-131-95-33-27-83(28-34-95)107(4,5)6)59-80(101(78)128-23)47-74-53-87(111(16,17)18)54-75(105(74)135-69-99-114-39-42-123(99)21)48-81-60-93(126-63-90(117-120-126)66-132-96-35-29-84(30-36-96)108(7,8)9)58-79(102(81)129-24)46-73-52-86(110(13,14)15)50-71(44-77(56-91)100(76)127-22)104(73)134-68-98-113-38-41-122(98)20/h25-42,49-63H,43-48,64-69H2,1-24H3
InChI key:
WQLDSYCTJMUIGL-UHFFFAOYSA-N
SMILES:
COc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc6cc(cc(Cc7cc(cc(Cc1cc(c2)n1cc(COc2ccc(cc2)C(C)(C)C)nn1)c7OCc1nccn1C)C(C)(C)C)c6OC)n1cc(COc2ccc(cc2)C(C)(C)C)nn1)c5OCc1nccn1C)C(C)(C)C)c4OC)n1cc(COc2ccc(cc2)C(C)(C)C)nn1)c3OCc1nccn1C)C(C)(C)C
Systematic name (5):
2,2′′,2′′′′-トリメトキシ-2′,2′′′,2′′′′′-トリス(1-メチル-1H-イミダゾール-2-イルメトキシ)-5,5′′,5′′′′-トリス[4-(4-tert-ブチルフェノキシメチル)-1H-1,2,3-トリアゾール-1-イル]-5′,5′′′,5′′′′′-トリ-tert-ブチル(1,3′-メチレン-1′,3′′-メチレン-1′′,3′′′-メチレン-1′′′,3′′′′-メチレン-1′′′′,3′′′′′-メチレン-1′′′′′,3-メチレンヘキサベンゼン)
5,17,29-トリ-tert-ブチル-11,23,35-トリス[4-[(4-tert-ブチルフェノキシ)メチル]1H-1,2,3-トリアゾール-1-イル]-37,39,41-トリメトキシ-38,40,42-トリス[(1-メチル-1H-イミダゾール-2-イル)メトキシ]ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン
11,23,35-トリ-tert-ブチル-38,40,42-トリメトキシ-5,17,29-トリス[4-(4-tert-ブチルフェノキシメチル)-1H-1,2,3-トリアゾール-1-イル]-37,39,41-トリス(1-メチル-1H-イミダゾール-2-イルメトキシ)ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン
4-[(4-tert-ブチルフェノキシ)メチル]-1-[11,23,35-トリ-tert-ブチル-17,29-ビス({4-[(4-tert-ブチルフェノキシ)メチル]-1H-1,2,3-トリアゾール-1-イル})-38,40,42-トリメトキシ-37,39,41-トリス[(1-メチル-1H-イミダゾール-2-イル)メトキシ]ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-5-イル]-1H-1,2,3-トリアゾール
4-[(4-tert-butylphenoxy)methyl]-1-[11,23,35-tri-tert-butyl-17,29-bis({4-[(4-tert-butylphenoxy)methyl]-1H-1,2,3-triazol-1-yl})-38,40,42-trimethoxy-37,39,41-tris[(1-methyl-1H-imidazol-2-yl)methoxy]heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaen-5-yl]-1H-1,2,3-triazole
Other name (3):
2,2′′,2′′′′-Trimethoxy-2′,2′′′,2′′′′′-tris(1-methyl-1H-imidazole-2-ylmethoxy)-5,5′′,5′′′′-tris[4-(4-tert-butylphenoxymethyl)-1H-1,2,3-triazole-1-yl]-5′,5′′′,5′′′′′-tri-tert-butyl(1,3′-methylene-1′,3′′-methylene-1′′,3′′′-methylene-1′′′,3′′′′-methylene-1′′′′,3′′′′′-methylene-1′′′′′,3-methylenehexabenzene)
5,17,29-Tri-tert-butyl-11,23,35-tris[4-[(4-tert-butylphenoxy)methyl]1H-1,2,3-triazole-1-yl]-37,39,41-trimethoxy-38,40,42-tris[(1-methyl-1H-imidazole-2-yl)methoxy]heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaene
11,23,35-Tri-tert-butyl-38,40,42-trimethoxy-5,17,29-tris[4-(4-tert-butylphenoxymethyl)-1H-1,2,3-triazole-1-yl]-37,39,41-tris(1-methyl-1H-imidazole-2-ylmethoxy)heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaene
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