Chem
J-GLOBAL ID：200907018127358989
Nikkaji number：J1.371.152F
35,41-Dioxa-1,9,17,25-tetraazaheptacyclo[15.15.5.59,25.13,7.111,15.119,23.127,31]hexatetracontane-3(46),4,6,11(45),12,14,19(44),20,22,27(38),28,30-dodecene
35,41-ジオキサ-1,9,17,25-テトラアザヘプタシクロ[15.15.5.59,25.13,7.111,15.119,23.127,31]ヘキサテトラコンタ-3,5,7(46),11,13,15(45),19(44),20,22,27(38),28,30-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： C40H48N4O2
Molecular formula furigana： C40-H48-N4-O2
Molecular weight： 616.850
InChI：
InChI=1S/C40H48N4O2/c1-5-33-21-34(6-1)26-42-14-18-46-19-15-43-29-37-9-2-7-35(22-37)27-41(25-33)13-17-45-20-16-44(30-38-10-3-8-36(23-38)28-42)32-40-12-4-11-39(24-40)31-43/h1-12,21-24H,13-20,25-32H2
InChI key：
UANZUMXFKCXTFM-UHFFFAOYSA-N
SMILES：
C1CN2Cc3cccc(CN4CCOCCN(Cc5cccc(C2)c5)Cc2cccc(CN(CCO1)Cc1cccc(C4)c1)c2)c3
Systematic name (5)：
- 35,41-ジオキサ-1,9,17,25-テトラアザヘプタシクロ[15.15.5.59,25.13,7.111,15.119,23.127,31]ヘキサテトラコンタン-3(46),4,6,11(45),12,14,19(44),20,22,27(38),28,30-ドデカエン
- 11,27-(オキシビスエチレン)-[3,19-(オキシビスエチレン)-3,11,19,27-テトラアザペンタシクロ[27.3.1.15,9.113,17.121,25]ヘキサトリアコンタン-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-ドデカエン]
- 11,27-(オキシビスエチレン)[3,19-(オキシビスエチレン)-3,11,19,27-テトラアザペンタシクロ[27.3.1.15,9.113,17.121,25]ヘキサトリアコンタ-1(33),5,7,9(36),13,15,17(35),21,23,25(34),29,31-ドデカエン]
- 35,41-ジオキサ-1,9,17,25-テトラアザヘプタシクロ[15.15.5.59,25.13,7.111,15.119,23.127,31]ヘキサテトラコンタ-3,5,7(46),11,13,15(45),19(44),20,22,27(38),28,30-ドデカエン
- 35,41-dioxa-1,9,17,25-tetraazaheptacyclo[15.15.5.59,25.13,7.111,15.119,23.127,31]hexatetraconta-3,5,7(46),11,13,15(45),19(44),20,22,27(38),28,30-dodecaene
- 35,41-Dioxa-1,9,17,25-tetraazaheptacyclo[15.15.5.59,25.13,7.111,15.119,23.127,31]hexatetracontane-3(46),4,6,11(45),12,14,19(44),20,22,27(38),28,30-dodecene
- 11,27-(Oxybisethylene)-[3,19-(oxybisethylene)-3,11,19,27-tetraazapentacyclo[27.3.1.15,9.113,17.121,25]hexatriacontane-1(33),5(36),6,8,13(35),14,16,21(34),22,24,29,31-dodecene]
- 11,27-(Oxybisethylene)[3,19-(oxybisethylene)-3,11,19,27-tetraazapentacyclo[27.3.1.15,9.113,17.121,25]hexatriaconta-1(33),5,7,9(36),13,15,17(35),21,23,25(34),29,31-dodecaene]
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