Chem
J-GLOBAL ID:201707003282701903   Nikkaji number:J3.669.078J

6-[[4-[2-[(4S,5R)-2-[6(1H)-Imino-9H-purine-9-yl]-5-(tert-butyldimethylsilyl)tetrahydrofuran-4-yl]-1,3-dithiane-2-yl]phenyl]aminocarbonyl]hexanehydroximic acid

6-[[4-[2-[(4S,5R)-2-[6(1H)-イミノ-9H-プリン-9-イル]-5-(tert-ブチルジメチルシリル)テトラヒドロフラン-4-イル]-1,3-ジチアン-2-イル]フェニル]アミノカルボニル]ヘキサンヒドロキシム酸
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: C32H47N7O4S2Si
Molecular formula furigana: C32-H47-N7-O4-S2-SI
Molecular weight: 685.980
InChI: InChI=1S/C32H47N7O4S2Si/c1-31(2,3)46(4,5)30-23(18-26(43-30)39-20-36-27-28(33)34-19-35-29(27)39)32(44-16-9-17-45-32)21-12-14-22(15-13-21)37-24(40)10-7-6-8-11-25(41)38-42/h12-15,19-20,23,26,30,42H,6-11,16-18H2,1-5H3,(H,37,40)(H,38,41)(H2,33,34,35)/t23-,26?,30+/m0/s1
InChI key: GTDXBWJEWBWTTB-UFWGVDHHSA-N
SMILES: CC(C)(C)[Si](C)(C)[C@H]1OC(C[C@@H]1C1(SCCCS1)c1ccc(NC(=O)CCCCCC(=NO)O)cc1)n1cnc2c1nc[nH]c2=N
Systematic name  (3):
  • 6-[[4-[2-[(4S,5R)-2-[6(1H)-イミノ-9H-プリン-9-イル]-5-(tert-ブチルジメチルシリル)テトラヒドロフラン-4-イル]-1,3-ジチアン-2-イル]フェニル]アミノカルボニル]ヘキサンヒドロキシム酸
  • N-ヒドロキシ6-[(4-{2-[(2R,3S)-2-(tert-ブチルジメチルシリル)-5-(6-イミノ-6,9-ジヒドロ-1H-プリン-9-イル)オキソラン-3-イル]-1,3-ジチアン-2-イル}フェニル)カルバモイル]ヘキサンイミド酸
  • N-hydroxy6-[(4-{2-[(2R,3S)-2-(tert-butyldimethylsilyl)-5-(6-imino-6,9-dihydro-1H-purin-9-yl)oxolan-3-yl]-1,3-dithian-2-yl}phenyl)carbamoyl]hexanimidic acid
Other name (1):
  • 6-[[4-[2-[(4S,5R)-2-[6(1H)-Imino-9H-purine-9-yl]-5-(tert-butyldimethylsilyl)tetrahydrofuran-4-yl]-1,3-dithiane-2-yl]phenyl]aminocarbonyl]hexanehydroximic acid
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