Chem
J-GLOBAL ID:200907049004737333
Nikkaji number:J683.151F
β-L-FddC-TP
2′,3′-ジデオキシ-5-フルオロシチジン5′-三りん酸
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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 H15 FN3 O12 P3
Molecular formula furigana:
C9-H15-F-N3-O12-P3
Molecular weight:
469.148
InChI:
InChI=1S/C9H15FN3O12P3/c10-6-3-13(9(14)12-8(6)11)7-2-1-5(23-7)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h3,5,7H,1-2,4H2,(H,18,19)(H,20,21)(H2,11,12,14)(H2,15,16,17)/t5-,7+/m0/s1
InChI key:
ARRTZUVEPRJLPK-CAHLUQPWSA-N
SMILES:
Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1
Systematic name (4):
2′,3′-ジデオキシ-5-フルオロシチジン5′-三りん酸
5-フルオロ-2′,3′-ジデオキシ-シチジン5′-三りん酸
({[({[(2S,5R)-5-(4-アミノ-5-フルオロ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)オキソラン-2-イル]メトキシ}(ヒドロキシ)ホスホリル)オキシ](ヒドロキシ)ホスホリル}オキシ)ホスホン酸
({[({[(2S,5R)-5-(4-amino-5-fluoro-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
Other name (3):
2′,3′-Dideoxy-5-fluorocytidine 5′-triphosphoric acid
5-Fluoro-2′,3′-dideoxy-cytidine 5′-triphosphoric acid
β-L-FddC-TP
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