Chem
J-GLOBAL ID：201307015589683137   Nikkaji number：J3.213.063A

1-[(2S)-2-[[(2S)-2-Aminobutanoyl]amino]dodecanoyl]-1,4,7,10-tetraazacyclododecane

1-[(2S)-2-[[(2S)-2-アミノブタノイル]アミノ]ドデカノイル]-1,4,7,10-テトラアザシクロドデカン
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： C24H50N6O2
Molecular formula furigana： C24-H50-N6-O2
Molecular weight： 454.704
InChI： InChI=1S/C24H50N6O2/c1-3-5-6-7-8-9-10-11-12-22(29-23(31)21(25)4-2)24(32)30-19-17-27-15-13-26-14-16-28-18-20-30/h21-22,26-28H,3-20,25H2,1-2H3,(H,29,31)/t21-,22-/m0/s1
InChI key： IHODZIVWSOWPHH-VXKWHMMOSA-N
SMILES： CCCCCCCCCC[C@H](NC(=O)[C@@H](N)CC)C(=O)N1CCNCCNCCNCC1
Systematic name  (3)：
  • 1-[(2S)-2-[[(2S)-2-アミノブタノイル]アミノ]ドデカノイル]-1,4,7,10-テトラアザシクロドデカン
  • (2S)-2-アミノ-N-[(2S)-1-オキソ-1-(1,4,7,10-テトラアザシクロドデカン-1-イル)ドデカン-2-イル]ブタンアミド
  • (2S)-2-amino-N-[(2S)-1-oxo-1-(1,4,7,10-tetraazacyclododecan-1-yl)dodecan-2-yl]butanamide
Other name (1)：
  • 1-[(2S)-2-[[(2S)-2-Aminobutanoyl]amino]dodecanoyl]-1,4,7,10-tetraazacyclododecane
Thsaurus map：
Thesaurus Map

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