Chem
J-GLOBAL ID：200907075929018800   Nikkaji number：J689.995A

N-Methyl-N-(2-bromoethyl)amidophosphoric acid 2′-deoxy-5′-uridyl 2-[2,2-dimethyl-1,3-dioxolan-4-yl]ethyl ester

N-メチル-N-(2-ブロモエチル)アミドりん酸2′-デオキシ-5′-ウリジル2-[2,2-ジメチル-1,3-ジオキソラン-4-イル]エチル
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： C19H31BrN3O9P
Molecular formula furigana： C19-H31-BR-N3-O9-P
Molecular weight： 556.347
InChI： InChI=1S/C19H31BrN3O9P/c1-19(2)28-11-13(32-19)5-9-29-33(27,22(3)8-6-20)30-12-15-14(24)10-17(31-15)23-7-4-16(25)21-18(23)26/h4,7,13-15,17,24H,5-6,8-12H2,1-3H3,(H,21,25,26)/t13?,14-,15+,17+,33?/m0/s1
InChI key： MGKFYLSINZQUEQ-PTSQDNAASA-N
SMILES： CN(CCBr)P(=O)(OCCC1COC(C)(C)O1)OC[C@H]1O[C@H](C[C@@H]1O)n1ccc(=O)[nH]c1=O
Systematic name  (3)：
  • N-メチル-N-(2-ブロモエチル)アミドりん酸2′-デオキシ-5′-ウリジル2-[2,2-ジメチル-1,3-ジオキソラン-4-イル]エチル
  • 1-[(2R,4S,5R)-5-[({[(2-ブロモエチル)(メチル)アミノ][2-(2,2-ジメチル-1,3-ジオキソラン-4-イル)エトキシ]ホスホリル}オキシ)メチル]-4-ヒドロキシオキソラン-2-イル]-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(2R,4S,5R)-5-[({[(2-bromoethyl)(methyl)amino][2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethoxy]phosphoryl}oxy)methyl]-4-hydroxyoxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • N-Methyl-N-(2-bromoethyl)amidophosphoric acid 2′-deoxy-5′-uridyl 2-[2,2-dimethyl-1,3-dioxolan-4-yl]ethyl ester
Thsaurus map：
Thesaurus Map

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