Chem
J-GLOBAL ID：201507000231423930   Nikkaji number：J3.400.880I

Pivalic acid [4-[2-[3-O-[(diisopropylamino)(2-cyanoethoxy)phosphino]-5-O-(4,4′-dimethoxytrityl)-2-deoxy-β-D-erythro-pentofuranosyl]ethyl]-1H-imidazole-1-yl]methyl ester

ピバル酸[4-[2-[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-(4,4′-ジメトキシトリチル)-2-デオキシ-β-D-erythro-ペントフラノシル]エチル]-1H-イミダゾール-1-イル]メチル
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： C46H61N4O8P
Molecular formula furigana： C46-H61-N4-O8-P
Molecular weight： 828.988
InChI： InChI=1S/C46H61N4O8P/c1-33(2)50(34(3)4)59(56-27-13-26-47)58-42-28-41(25-20-38-29-49(31-48-38)32-54-44(51)45(5,6)7)57-43(42)30-55-46(35-14-11-10-12-15-35,36-16-21-39(52-8)22-17-36)37-18-23-40(53-9)24-19-37/h10-12,14-19,21-24,29,31,33-34,41-43H,13,20,25,27-28,30,32H2,1-9H3/t41-,42-,43+,59?/m0/s1
InChI key： DJFUVOBZMANYPU-KPIXOWQWSA-N
SMILES： COc1ccc(cc1)C(OC[C@H]1O[C@@H](CCc2cn(COC(=O)C(C)(C)C)cn2)C[C@@H]1OP(OCCC#N)N(C(C)C)C(C)C)(c1ccccc1)c1ccc(OC)cc1
Systematic name  (3)：
  • ピバル酸[4-[2-[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-(4,4′-ジメトキシトリチル)-2-デオキシ-β-D-erythro-ペントフラノシル]エチル]-1H-イミダゾール-1-イル]メチル
  • (4-{2-[(2S,4S,5R)-5-{[ビス(4-メトキシフェニル)(フェニル)メトキシ]メチル}-4-({[ビス(プロパン-2-イル)アミノ](2-シアノエトキシ)ホスファニル}オキシ)オキソラン-2-イル]エチル}-1H-イミダゾール-1-イル)メチル 2,2-ジメチルプロパノアート
  • (4-{2-[(2S,4S,5R)-5-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-({[bis(propan-2-yl)amino](2-cyanoethoxy)phosphanyl}oxy)oxolan-2-yl]ethyl}-1H-imidazol-1-yl)methyl 2,2-dimethylpropanoate
Other name (1)：
  • Pivalic acid [4-[2-[3-O-[(diisopropylamino)(2-cyanoethoxy)phosphino]-5-O-(4,4′-dimethoxytrityl)-2-deoxy-β-D-erythro-pentofuranosyl]ethyl]-1H-imidazole-1-yl]methyl ester
Thsaurus map：
Thesaurus Map

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