Chem
J-GLOBAL ID:201207043560781659
Nikkaji number:J3.010.181B
3′-O-Benzyl-2-chloro-5′-O-(tert-butyldimethylsilyl)-2′-deoxy(N-15 N)adenosine
3′-O-ベンジル-2-クロロ-5′-O-(tert-ブチルジメチルシリル)-2′-デオキシ(N-15 N)アデノシン
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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:
C23 H32 ClN4 [15 N]O3 Si
Molecular formula furigana:
C23-H32-CL-N5-O3-SI
Molecular weight:
491.070
InChI:
InChI=1S/C23H32ClN5O3Si/c1-23(2,3)33(4,5)31-13-17-16(30-12-15-9-7-6-8-10-15)11-18(32-17)29-14-26-19-20(25)27-22(24)28-21(19)29/h6-10,14,16-18H,11-13H2,1-5H3,(H2,25,27,28)/t16-,17+,18+/m0/s1/i25+1
InChI key:
FVWFKASWJAPQND-HEDPSFPVSA-N
SMILES:
CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](C[C@@H]1OCc1ccccc1)n1cnc2c([15NH2])nc(Cl)nc12
Systematic name (3):
3′-O-ベンジル-2-クロロ-5′-O-(tert-ブチルジメチルシリル)-2′-デオキシ(N-15 N)アデノシン
9-[(2R,4S,5R)-4-(ベンジルオキシ)-5-{[(tert-ブチルジメチルシリル)オキシ]メチル}オキソラン-2-イル]-2-クロロ-9H-プリン-6-(15 N)アミン
9-[(2R,4S,5R)-4-(benzyloxy)-5-{[(tert-butyldimethylsilyl)oxy]methyl}oxolan-2-yl]-2-chloro-9H-purin-6-(15 N)amine
Other name (1):
3′-O-Benzyl-2-chloro-5′-O-(tert-butyldimethylsilyl)-2′-deoxy(N-15 N)adenosine
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