Chem
J-GLOBAL ID:200907017902166440
Nikkaji number:J905.809E
9-[2-O,3-O,5-O-Tris(tert-butyldimethylsilyl)-β-D-ribofuranosyl]-6-chloro-2-benzoyl-9H-purine
9-[2-O,3-O,5-O-トリス(tert-ブチルジメチルシリル)-β-D-リボフラノシル]-6-クロロ-2-ベンゾイル-9H-プリン
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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:
C35 H57 ClN4 O5 Si3
Molecular formula furigana:
C35-H57-CL-N4-O5-SI3
Molecular weight:
733.570
InChI:
InChI=1S/C35H57ClN4O5Si3/c1-33(2,3)46(10,11)42-21-24-27(44-47(12,13)34(4,5)6)28(45-48(14,15)35(7,8)9)32(43-24)40-22-37-25-29(36)38-30(39-31(25)40)26(41)23-19-17-16-18-20-23/h16-20,22,24,27-28,32H,21H2,1-15H3/t24-,27-,28-,32-/m1/s1
InChI key:
NMTADCWYVJYPRC-SLXDEKLDSA-N
SMILES:
CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H]([C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C)n1cnc2c(Cl)nc(nc12)C(=O)c1ccccc1
Systematic name (3):
9-[2-O,3-O,5-O-トリス(tert-ブチルジメチルシリル)-β-D-リボフラノシル]-6-クロロ-2-ベンゾイル-9H-プリン
2-ベンゾイル-9-[(2R,3R,4R,5R)-3,4-ビス[(tert-ブチルジメチルシリル)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]-6-クロロ-9H-プリン
2-benzoyl-9-[(2R,3R,4R,5R)-3,4-bis[(tert-butyldimethylsilyl)oxy]-5-{[(tert-butyldimethylsilyl)oxy]methyl}oxolan-2-yl]-6-chloro-9H-purine
Other name (1):
9-[2-O,3-O,5-O-Tris(tert-butyldimethylsilyl)-β-D-ribofuranosyl]-6-chloro-2-benzoyl-9H-purine
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