Chem
J-GLOBAL ID:200907054345345631
Nikkaji number:J1.036.815D
4-Amino-1-[(3S)-4α-hydroxy-5β-(hydroxymethyl)tetrahydrothiophene-3β-yl]pyrimidine-2(1H)-one
4-アミノ-1-[(3S)-4α-ヒドロキシ-5β-(ヒドロキシメチル)テトラヒドロチオフェン-3β-イル]ピリミジン-2(1H)-オン
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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:
C9 H13 N3 O3 S
Molecular formula furigana:
C9-H13-N3-O3-S
Molecular weight:
243.280
InChI:
InChI=1S/C9H13N3O3S/c10-7-1-2-12(9(15)11-7)5-4-16-6(3-13)8(5)14/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)/t5-,6-,8+/m1/s1
InChI key:
WVQFGCQULIWFEA-JKMUOGBPSA-N
SMILES:
Nc1ccn([C@@H]2CS[C@H](CO)[C@H]2O)c(=O)n1
Systematic name (3):
4-アミノ-1-[(3S)-4α-ヒドロキシ-5β-(ヒドロキシメチル)テトラヒドロチオフェン-3β-イル]ピリミジン-2(1H)-オン
4-アミノ-1-[(3S,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)チオラン-3-イル]-1,2-ジヒドロピリミジン-2-オン
4-amino-1-[(3S,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-3-yl]-1,2-dihydropyrimidin-2-one
Other name (1):
4-Amino-1-[(3S)-4α-hydroxy-5β-(hydroxymethyl)tetrahydrothiophene-3β-yl]pyrimidine-2(1H)-one
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