Chem
J-GLOBAL ID:200907031856168525
Nikkaji number:J2.560.803H
RO-9187
1-(4-アジド-β-D-アラビノフラノシル)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:
C9 H12 N4 [N-][N+]O5
Molecular formula furigana:
C9-H12-N6-O5
Molecular weight:
284.232
InChI:
InChI=1S/C9H12N6O5/c10-4-1-2-15(8(19)12-4)7-5(17)6(18)9(3-16,20-7)13-14-11/h1-2,5-7,16-18H,3H2,(H2,10,12,19)/t5-,6-,7+,9+/m0/s1
InChI key:
ODLGMSQBFONGNG-XZMZPDFPSA-N
SMILES:
Nc1ccn([C@@H]2O[C@@](CO)(N=[N+]=[N-])[C@@H](O)[C@@H]2O)c(=O)n1
Systematic name (3):
1-(4-アジド-β-D-アラビノフラノシル)シトシン
4-アミノ-1-[(2R,3S,4S,5R)-5-アジド-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-1,2-ジヒドロピリミジン-2-オン
4-amino-1-[(2R,3S,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
Other name (2):
1-(4-Azido-β-D-arabinofuranosyl)cytosine
RO-9187
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