Chem
J-GLOBAL ID：200907094071198582   Nikkaji number：J1.832.682E

1-[2-O,4-C-Methylene-3-O-[(diisopropylamino)(2-cyanoethoxy)phosphino]-5-O-[α,α-bis(4-methoxyphenyl)benzyl]-β-D-ribofuranosyl]-5-methylpyridine-2(1H)-one

1-[2-O,4-C-メチレン-3-O-[(ジイソプロピルアミノ)(2-シアノエトキシ)ホスフィノ]-5-O-[α,α-ビス(4-メトキシフェニル)ベンジル]-β-D-リボフラノシル]-5-メチルピリジン-2(1H)-オン
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： C42H50N3O8P
Molecular formula furigana： C42-H50-N3-O8-P
Molecular weight： 755.849
InChI： InChI=1S/C42H50N3O8P/c1-29(2)45(30(3)4)54(51-25-11-24-43)53-39-38-40(44-26-31(5)14-23-37(44)46)52-41(39,27-49-38)28-50-42(32-12-9-8-10-13-32,33-15-19-35(47-6)20-16-33)34-17-21-36(48-7)22-18-34/h8-10,12-23,26,29-30,38-40H,11,25,27-28H2,1-7H3/t38-,39+,40-,41-,54?/m1/s1
InChI key： FIFBTZFLHHSYQY-CQOBZNDRSA-N
SMILES： COc1ccc(cc1)C(OC[C@@]12CO[C@@H]([C@@H](O1)n1cc(C)ccc1=O)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c1ccccc1)c1ccc(OC)cc1
Systematic name  (3)：
  • 1-[2-O,4-C-メチレン-3-O-[(ジイソプロピルアミノ)(2-シアノエトキシ)ホスフィノ]-5-O-[α,α-ビス(4-メトキシフェニル)ベンジル]-β-D-リボフラノシル]-5-メチルピリジン-2(1H)-オン
  • 3-[({[(1R,3R,4R,7S)-1-{[ビス(4-メトキシフェニル)(フェニル)メトキシ]メチル}-3-(5-メチル-2-オキソ-1,2-ジヒドロピリジン-1-イル)-2,5-ジオキサビシクロ[2.2.1]ヘプタン-7-イル]オキシ}[ビス(プロパン-2-イル)アミノ]ホスファニル)オキシ]プロパンニトリル
  • 3-[({[(1R,3R,4R,7S)-1-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-3-(5-methyl-2-oxo-1,2-dihydropyridin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl]oxy}[bis(propan-2-yl)amino]phosphanyl)oxy]propanenitrile
Other name (1)：
  • 1-[2-O,4-C-Methylene-3-O-[(diisopropylamino)(2-cyanoethoxy)phosphino]-5-O-[α,α-bis(4-methoxyphenyl)benzyl]-β-D-ribofuranosyl]-5-methylpyridine-2(1H)-one
Thsaurus map：
Thesaurus Map

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