Chem
J-GLOBAL ID：200907092490735889   Nikkaji number：J1.067.772F

5-[6-[5-(9-Acridinyl)valerylamino]-1-hexynyl]-2′-deoxyuridine

5-[6-[5-(9-アクリジニル)バレリルアミノ]-1-ヘキシニル]-2′-デオキシウリジン
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： C33H36N4O6
Molecular formula furigana： C33-H36-N4-O6
Molecular weight： 584.673
InChI： InChI=1S/C33H36N4O6/c38-21-29-28(39)19-31(43-29)37-20-22(32(41)36-33(37)42)11-3-1-2-10-18-34-30(40)17-9-6-12-23-24-13-4-7-15-26(24)35-27-16-8-5-14-25(23)27/h4-5,7-8,13-16,20,28-29,31,38-39H,1-2,6,9-10,12,17-19,21H2,(H,34,40)(H,36,41,42)/t28-,29+,31+/m0/s1
InChI key： NKNIOCNVZULFBJ-ILJQZKEFSA-N
SMILES： OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C#CCCCCNC(=O)CCCCc2c3ccccc3nc3ccccc23)c(=O)[nH]c1=O
Systematic name  (3)：
  • 5-[6-[5-(9-アクリジニル)バレリルアミノ]-1-ヘキシニル]-2′-デオキシウリジン
  • 5-(アクリジン-9-イル)-N-(6-{1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-5-イル}ヘキサ-5-イン-1-イル)ペンタンアミド
  • 5-(acridin-9-yl)-N-(6-{1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl}hex-5-yn-1-yl)pentanamide
Other name (1)：
  • 5-[6-[5-(9-Acridinyl)valerylamino]-1-hexynyl]-2′-deoxyuridine
Thsaurus map：
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