Chem
J-GLOBAL ID:200907048541573804   Nikkaji number:J1.554.515A

N-Benzoyl-5-[[(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)oxy]methyl]-2′-deoxycytidine

N-ベンゾイル-5-[[(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)オキシ]メチル]-2′-デオキシシチジン
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: C31H37N3O15
Molecular formula furigana: C31-H37-N3-O15
Molecular weight: 691.643
InChI: InChI=1S/C31H37N3O15/c1-15(36)43-14-23-25(45-16(2)37)26(46-17(3)38)27(47-18(4)39)30(49-23)44-13-20-11-34(24-10-21(40)22(12-35)48-24)31(42)33-28(20)32-29(41)19-8-6-5-7-9-19/h5-9,11,21-27,30,35,40H,10,12-14H2,1-4H3,(H,32,33,41,42)/t21-,22+,23+,24+,25+,26-,27+,30+/m0/s1
InChI key: QXLKCKODSAHRHM-UGWGTLJESA-N
SMILES: CC(=O)OC[C@H]1O[C@@H](OCc2cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)nc2NC(=O)c2ccccc2)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C
Systematic name  (3):
  • N-ベンゾイル-5-[[(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)オキシ]メチル]-2′-デオキシシチジン
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-({4-ベンズアミド-1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-2-オキソ-1,2-ジヒドロピリミジン-5-イル}メトキシ)オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-({4-benzamido-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-1,2-dihydropyrimidin-5-yl}methoxy)oxan-2-yl]methyl acetate
Other name (1):
  • N-Benzoyl-5-[[(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)oxy]methyl]-2′-deoxycytidine
Thsaurus map:

Return to Previous Page