Chem
J-GLOBAL ID:200907010348014345
Nikkaji number:J380.101B
N-Acetyl-1-(2-O-acetyl-3-deoxy-β-D-threo-pentofuranosyl)cytosine
N-アセチル-1-(2-O-アセチル-3-デオキシ-β-D-threo-ペントフラノシル)シトシン
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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:
C13 H17 N3 O6
Molecular formula furigana:
C13-H17-N3-O6
Molecular weight:
311.294
InChI:
InChI=1S/C13H17N3O6/c1-7(18)14-11-3-4-16(13(20)15-11)12-10(21-8(2)19)5-9(6-17)22-12/h3-4,9-10,12,17H,5-6H2,1-2H3,(H,14,15,18,20)/t9-,10-,12+/m0/s1
InChI key:
HNRQNEZMNHOBAF-JBLDHEPKSA-N
SMILES:
CC(=O)Nc1ccn([C@@H]2O[C@H](CO)C[C@@H]2OC(=O)C)c(=O)n1
Systematic name (3):
N-アセチル-1-(2-O-アセチル-3-デオキシ-β-D-threo-ペントフラノシル)シトシン
(2R,3S,5S)-2-(4-アセトアミド-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-5-(ヒドロキシメチル)オキソラン-3-イル アセタート
(2R,3S,5S)-2-(4-acetamido-2-oxo-1,2-dihydropyrimidin-1-yl)-5-(hydroxymethyl)oxolan-3-yl acetate
Other name (1):
N-Acetyl-1-(2-O-acetyl-3-deoxy-β-D-threo-pentofuranosyl)cytosine
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