Chem
J-GLOBAL ID：200907084947592024   Nikkaji number：J2.766.238B

N-[2-(4-Benzoylbenzoylamino)ethyl]carbamic acid 6,11-bis(iminio)-2,2-dihydroxy-5,7,10,12-tetraazatricyclo[7.3.0.01,5]dodecane-8β-ylmethyl ester

(4R)-4-{[({2-[(4-ベンゾイルフェニル)ホルムアミド]エチル}カルバモイル)オキシ]メチル}-10,10-ジヒドロキシ-デカヒドロピロロ[1,2-c]プリン-2,6-ビス(イミニウム)
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： C26H32N6[N+]2O6
Molecular formula furigana： C26-H32-N8-O6
Molecular weight： 552.591
InChI： InChI=1S/C26H30N8O6/c27-22-32-20-18(31-23(28)34-13-10-25(38,39)26(20,34)33-22)14-40-24(37)30-12-11-29-21(36)17-8-6-16(7-9-17)19(35)15-4-2-1-3-5-15/h1-9,18,20,38-39H,10-14H2,(H2,28,31)(H,29,36)(H,30,37)(H3,27,32,33)/p+2/t18-,20?,26?/m0/s1
InChI key： JWYKWNDKUBQJIF-FIHXVCSCSA-P
SMILES： OC1(O)CCN2C(=[NH2+])N[C@@H](COC(=O)NCCNC(=O)c3ccc(cc3)C(=O)c3ccccc3)C3NC(=[NH2+])NC123
Systematic name  (3)：
  • N-[2-(4-ベンゾイルベンゾイルアミノ)エチル]カルバミド酸6,11-ビス(イミニオ)-2,2-ジヒドロキシ-5,7,10,12-テトラアザトリシクロ[7.3.0.01,5]ドデカン-8β-イルメチル
  • (4R)-4-{[({2-[(4-ベンゾイルフェニル)ホルムアミド]エチル}カルバモイル)オキシ]メチル}-10,10-ジヒドロキシ-デカヒドロピロロ[1,2-c]プリン-2,6-ビス(イミニウム)
  • (4R)-4-{[({2-[(4-benzoylphenyl)formamido]ethyl}carbamoyl)oxy]methyl}-10,10-dihydroxy-decahydropyrrolo[1,2-c]purine-2,6-bis(iminium)
Other name (1)：
  • N-[2-(4-Benzoylbenzoylamino)ethyl]carbamic acid 6,11-bis(iminio)-2,2-dihydroxy-5,7,10,12-tetraazatricyclo[7.3.0.01,5]dodecane-8β-ylmethyl ester
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM