RF5
Summary
Name: | 2-deoxy-2-fluoro-5-O-phosphono-alpha-D-arabinofuranose |
Synonyms: | Inhibitor arabinosyl-2-fluoro-2-deoxynicotinamide mononucleotide, bound form 2-deoxy-2-fluoro-5-O-phosphono-alpha-D-arabinose; 2-deoxy-2-fluoro-5-O-phosphono-D-arabinose; 2-deoxy-2-fluoro-5-O-phosphono-arabinose |
Formula: | C5 H10 F O7 P |
Formal charge: | 0 |
Formula weight: | 232.101 Da |
Component type: | D-saccharide, alpha linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-deoxy-2-fluoro-5-O-phosphono-alpha-D-arabinofuranose |
OpenEye OEToolkits | 1.7.6 | [(2R,3R,4S,5S)-4-fluoranyl-3,5-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
PDB-CARE | 1.0 | a-D-Araf2fluoro5PO3 |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | FC1C(O)C(OC1O)COP(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C5H10FO7P/c6-3-4(7)2(13-5(3)8)1-12-14(9,10)11/h2-5,7-8H,1H2,(H2,9,10,11)/t2-,3+,4-,5+/m1/s1 |
InChIKey | InChI | 1.03 | NOTDWSJIOCLYHZ-LECHCGJUSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | O[C@H]1O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@@H]1F |
SMILES | CACTVS | 3.370 | O[CH]1O[CH](CO[P](O)(O)=O)[CH](O)[CH]1F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C([C@@H]1[C@H]([C@@H]([C@H](O1)O)F)O)OP(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(C1C(C(C(O1)O)F)O)OP(=O)(O)O |