Chem
J-GLOBAL ID：200907002977438368   Nikkaji number：J1.860.289J

Hemicucurbit[12]uril

ヘミククルビト[12]ウリル
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： C48H72N24O12
Molecular formula furigana： C48-H72-N24-O12
Molecular weight： 1177.260
InChI： InChI=1S/C48H72N24O12/c73-37-49-1-2-50(37)26-52-5-6-54(39(52)75)28-56-9-10-58(41(56)77)30-60-13-14-62(43(60)79)32-64-17-18-66(45(64)81)34-68-21-22-70(47(68)83)36-72-24-23-71(48(72)84)35-69-20-19-67(46(69)82)33-65-16-15-63(44(65)80)31-61-12-11-59(42(61)78)29-57-8-7-55(40(57)76)27-53-4-3-51(25-49)38(53)74/h1-36H2
InChI key： RWJKULNYAIFYPO-UHFFFAOYSA-N
SMILES： O=C1N2CCN1CN1CCN(CN3CCN(CN4CCN(CN5CCN(CN6CCN(CN7CCN(CN8CCN(CN9CCN(CN%10CCN(CN%11CCN(CN%12CCN(C2)C%12=O)C%11=O)C%10=O)C9=O)C8=O)C7=O)C6=O)C5=O)C4=O)C3=O)C1=O
Systematic name  (4)：
  • 1,3,6,8,11,13,16,18,21,23,26,28,31,33,36,38,41,43,46,48,51,53,56,58-テトラコサアザトリデカシクロ[56.2.1.13,6.18,11.113,16.118,21.123,26.128,31.133,36.138,41.143,46.148,51.153,56]ドヘプタコンタン-61,62,63,64,65,66,67,68,69,70,71,72-ドデカオン
  • 1,3-[2-オキソイミダゾリジン-1,3-ジイルビス[メチレン(2-オキソイミダゾリジン-1,3-ジイル)メチレン(2-オキソイミダゾリジン-1,3-ジイル)メチレン(2-オキソイミダゾリジン-1,3-ジイル)メチレン(2-オキソイミダゾリジン-1,3-ジイル)メチレン(2-オキソイミダゾリジン-1,3-ジイル)メチレン]]-2-オキソイミダゾリジン
  • 1,3-[2-オキソイミダゾリジン-1,3-ジイルビス[メチレン[2-オキソイミダゾリジン-1,3-ジイルメチレン[2-オキソイミダゾリジン-1,3-ジイルメチレン[2-オキソイミダゾリジン-1,3-ジイルメチレン[2-オキソイミダゾリジン-1,3-ジイルメチレン(2-オキソイミダゾリジン-1,3-ジイルメチレン)]]]]]]イミダゾリジン-2-オン
  • 1,3,6,8,11,13,16,18,21,23,26,28,31,33,36,38,41,43,46,48,51,53,56,58-tetracosaazatridecacyclo[56.2.1.13,6.18,11.113,16.118,21.123,26.128,31.133,36.138,41.143,46.148,51.153,56]doheptacontane-61,62,63,64,65,66,67,68,69,70,71,72-dodecone
Other name (5)：
  • 1,3,6,8,11,13,16,18,21,23,26,28,31,33,36,38,41,43,46,48,51,53,56,58-Tetracosaazatridecacyclo[56.2.1.13,6.18,11.113,16.118,21.123,26.128,31.133,36.138,41.143,46.148,51.153,56]doheptacontane-61,62,63,64,65,66,67,68,69,70,71,72-dodecone
  • 1,3-[2-Oxoimidazolidine-1,3-diylbis[methylene(2-oxoimidazolidine-1,3-diyl)methylene(2-oxoimidazolidine-1,3-diyl)methylene(2-oxoimidazolidine-1,3-diyl)methylene(2-oxoimidazolidine-1,3-diyl)methylene(2-oxoimidazolidine-1,3-diyl)methylene]]-2-oxoimidazolidine
  • 1,3-[2-Oxoimidazolidine-1,3-diylbis[methylene[2-oxoimidazolidine-1,3-diylmethylene[2-oxoimidazolidine-1,3-diylmethylene[2-oxoimidazolidine-1,3-diylmethylene[2-oxoimidazolidine-1,3-diylmethylene(2-oxoimidazolidine-1,3-diylmethylene)]]]]]]imidazolidine-2-one
  • ヘミククルビト[12]ウリル
  • Hemicucurbit[12]uril
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